SCHEMBL335673

SCHEMBL335673

COC(=O)c1ccc(C)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.56
RAB9A P51151 8/20 0.56
HPGD P15428 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
MAPT P10636 3/20 0.55
CYP1A2 P05177 2/20 0.55
CYP3A4 P08684 2/20 0.55
CYP2C19 P33261 2/20 0.55
LMNA P02545 1/20 0.55
CYP2C9 P11712 1/20 0.55
PKM P14618 2/20 0.54
ALOX15 P16050 1/20 0.52
ABL1 P00519 1/20 0.51
NR4A2 P43354 2/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
CYP46A1 Q9Y6A2 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HTT P42858 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23226657 0.86 PDK2 (0.51) NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL30740721 0.85 RAB9A (0.49) NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL844384 0.85 MEN1 (0.54) RAB9AHPGDSMN1; SMN2MAPTLMNA
SCHEMBL25483438 0.85 NPC1 (0.56) NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL393318 0.83 NR4A2 (0.51) HPGDMAPTABL1NR4A2ALDH1A1
SCHEMBL28809713 0.83 NPC1 (0.59) NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL28765390 0.83 NPC1 (0.55) NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL28792279 0.83 RAB9A (0.55) NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL608814 0.82 ABL1 (0.68) NPC1RAB9AHPGDSMN1; SMN2MAPT
SCHEMBL2884923 0.82 PDK2 (0.57) NPC1RAB9AHPGDSMN1; SMN2MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 73 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6225514-B1 A MIXTURE OF AN AROMATIC HYDROCARBON, ESTER, NITRILE OR HALOGENATED AROMATIC, A HALOGENATING AGENT AND A STABLE ACID,AND CORROSION RESISTANT, HETEROGENEOUS, SOLID ACID CATALYST OF ?DOPED? MIXED OXIDES; BY-PRODUCT INHIBITION OCCIDENTAL CHEMICAL CORPORATION 2001-05-01 US claimed
US-6124512-A HETEROGENEOUS CATALYST. OCCIDENTAL CHEMICAL CORPORATION (US) 2000-09-26 US claimed
CN-116375684-B AChE-EGFR double-target inhibitor and preparation method and application thereof 中国药科大学 2024-03-26 CN disclosed
US-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators ILDONG PHARMACEUTICAL CO., LTD. (KR) 2023-11-28 US disclosed
CN-116375684-A AChE-EGFR double-target inhibitor and preparation method and application thereof 中国药科大学 2023-07-04 CN disclosed
US-20230150993-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF VERTEX PHARMACEUTICALS INCORPORATED 2023-05-18 US disclosed
US-20230133817-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2023-05-04 US disclosed
US-20230133667-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX PHARMACEUTICALS INC (US) 2023-05-04 US disclosed
US-20230114674-A1 ISOINDOLINE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF KANGPU BIOPHARMACEUTICALS, LTD. (CN) 2023-04-13 US disclosed
EP-4095132-A1 ISOINDOLINE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF Kangpu Biopharmaceuticals, Ltd. (CN) 2022-11-30 EP disclosed
CN-115038694-A Isoindoline derivative, pharmaceutical composition and application thereof 康朴生物医药技术(上海)有限公司 2022-09-09 CN disclosed
US-20040157741-A1 Benzoylsulfonamides and sulfonylbenzamidines for use as antitumour agents ELI LILLY AND COMPANY 2004-08-12 US disclosed
EP-1442030-A1 THIOPENE- AMD THIAZOLESULFONAMIDES AS ANTINEOPLASTIC AGENTS ELI LILLY AND COMPANY (US) 2004-08-04 EP disclosed
EP-1401806-A1 BENZOYLSULFONAMIDES AND SULFONYLBENZAMIDINES FOR USE AS ANTITUMOUR AGENTS ELI LILLY AND COMPANY (US) 2004-03-31 EP disclosed
WO-2003068233-A1 NICOTINAMIDE DERIVATIVES AND A TIOTROPIUM SALT IN COMBINATION FOR THE TREATMENT OF E.G. INFLAMMATORY, ALLERGIC AND RESPIRATORY DISEASES PFIZER LIMITED (GB) 2003-08-21 WO disclosed
WO-2003035629-A1 THIOPENE- AMD THIAZOLESULFONAMIDES AS ANTINEOPLASTIC AGENTS ELI LILLY AND COMPANY (US) 2003-05-01 WO disclosed
WO-2002098848-A1 BENZOYLSULFONAMIDES AND SULFONYLBENZAMIDINES FOR USE AS ANTITUMOUR AGENTS ELI LILLY AND COMPANY (US) 2002-12-12 WO disclosed
US-6225514-B1 A MIXTURE OF AN AROMATIC HYDROCARBON, ESTER, NITRILE OR HALOGENATED AROMATIC, A HALOGENATING AGENT AND A STABLE ACID,AND CORROSION RESISTANT, HETEROGENEOUS, SOLID ACID CATALYST OF ?DOPED? MIXED OXIDES; BY-PRODUCT INHIBITION OCCIDENTAL CHEMICAL CORPORATION 2001-05-01 US disclosed
US-6153651-A Ortho-substituted benzoylguanidines, process for their preparation, their use as a medicament or diagnostic, and medicament comprising them HOECHST AKTIENGESELLSCHAFT (DE) 2000-11-28 US disclosed
US-6124512-A HETEROGENEOUS CATALYST. OCCIDENTAL CHEMICAL CORPORATION (US) 2000-09-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040157741-A1 Benzoylsulfonamides and sulfonylbenzamidines for use as antitumour agents GLS2, GLS, MCL1 NPC1 1432/4885RAB9A 1952/4885HPGD 3528/4885
US-11827640-B2 Substituted pyrazolo[1,5-a]pyrimidines as CFTR modulators PDE4A, PDE4B, PDE5A NPC1 1428/4885RAB9A 604/4885HPGD 312/4885
US-20230150993-A1 ANTIPROLIFERATION COMPOUNDS AND USES THEREOF MKI67, MCL1, CCNI NPC1 286/4885RAB9A 1818/4885HPGD 157/4885
US-20230133817-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS MRPL21, PEPD, CTSC NPC1 1905/4885RAB9A 2372/4885HPGD 4261/4885
US-20230133667-A1 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS MRPL21, PEPD, CTSC NPC1 1905/4885RAB9A 2372/4885HPGD 4261/4885
US-20230114674-A1 ISOINDOLINE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF CRBN, CREBBP, CDR2 NPC1 437/4885RAB9A 3792/4885HPGD 394/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.