SCHEMBL108063

SCHEMBL108063

COc1cc(N)c(Cl)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 1.00
GAA P10253 3/20 0.68
HSP90AA1 P07900 2/20 0.47
HSP90AB1 P08238 2/20 0.47
TAAR1 Q96RJ0 1/20 0.47
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43
TUBA3E Q6PEY2 1/20 0.43
TUBA1A Q71U36 1/20 0.43
TUBA1C Q9BQE3 1/20 0.43
TUBB6 Q9BUF5 1/20 0.43
TUBB2B Q9BVA1 1/20 0.43
TUBB1 Q9H4B7 1/20 0.43

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
SCHEMBL29601238 1.00 NPC1 (1.00) NPC1GAAHSP90AA1HSP90AB1TAAR1
Hydrochloric Acid SCHEMBL3276689 0.98 NPC1 (0.95) NPC1GAAHSP90AA1HSP90AB1TAAR1
SCHEMBL9116148 0.91 NPC1 (0.83) NPC1GAAHSP90AA1HSP90AB1TAAR1
SCHEMBL5951825 0.88 GAA (0.78) NPC1GAAHSP90AA1HSP90AB1TAAR1
SCHEMBL1707866 0.88 NPC1 (0.78) NPC1GAATAAR1TUBB4ATUBB
SCHEMBL4805724 0.86 GAA (0.75) NPC1GAATUBB4ATUBBTUBA3C
SCHEMBL29466462 0.86 GAA (0.83) NPC1GAAHSP90AA1HSP90AB1TAAR1
SCHEMBL92067 0.86 GAA (0.83) NPC1GAAHSP90AA1HSP90AB1TAAR1
Hydrochloric Acid SCHEMBL1401287 0.86 GAA (0.75) NPC1GAAHSP90AA1HSP90AB1TAAR1
Hydrochloric Acid SCHEMBL5011472 0.84 GAA (0.79) NPC1GAAHSP90AA1HSP90AB1TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118745133-A Process for synthesizing dichloro amino aryl ether 南京工业大学 2024-10-08 CN claimed
EP-4402132-A1 FABP4/5 INHIBITORS, METHODS OF USE AND METHODS OF MAKING Celloram, Inc. (US) 2024-07-24 EP claimed
CN-118103357-A FABP4/5 inhibitors, methods of use and methods of preparation 塞洛拉姆股份有限公司 2024-05-28 CN claimed
WO-2023043803-A1 FABP4/5 INHIBITORS, METHODS OF USE AND METHODS OF MAKING NOVIUS THERAPEUTICS, LLC (US) 2023-03-23 WO claimed
CN-111116396-B Preparation method of bosutinib raw material 江苏远大仙乐药业有限公司 2022-04-15 CN claimed
CN-111116397-B Synthesis method of bosutinib intermediate 江苏远大仙乐药业有限公司 2022-04-15 CN claimed
CN-110204490-B Preparation method of disubstituted 4-chloroquinoline-3-carbonitrile derivative and bosutinib 新发药业有限公司 2021-01-01 CN claimed
CN-111116396-A Preparation method of bosutinib raw material 江苏远大仙乐药业有限公司 2020-05-08 CN claimed
CN-111116397-A Synthesis method of bosutinib intermediate 江苏远大仙乐药业有限公司 2020-05-08 CN claimed
WO-2019186429-A1 A PROCESS FOR THE PREPARATION OF BOSUTINIB SUN PHARMACEUTICAL INDUSTRIES LIMITED (IN) 2019-10-03 WO claimed
CN-104876865-A Preparation technology of bosutinib NANJING LYNSCI CHEMICAL CO LTD 2015-09-02 CN claimed
US-8288552-B2 Dihydropyridone amidesas P2X7 modulators ROCHE PALO ALTO LLC (US) 2012-10-16 US claimed
US-4310623-A THIO-PYRAZOLINE COUPLER FUJI PHOTO FILM CO., LTD. (JP) 1982-01-12 US claimed
US-4288362-A Monoazo pigments containing a quinazo linonylacetoacetanilide coupling component BAYER AKTIENGESELLSCHAFT (DE) 1981-09-08 US claimed
US-4264723-A CONTAINING PYRAZOLONE COUPLERS FUJI PHOTO FILM CO., LTD. (JP) 1981-04-28 US claimed
US-20260132106-A1 FABP4/5 INHIBITORS, METHODS OF USE AND METHODS OF MAKING CELLORAM, INC. (US) 2026-05-14 US disclosed
EP-3398939-B1 ACRYLANILIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATIONS THEREOF IN PHARMACY ANCUREALL PHARMACEUTICAL SHANGHAI CO LTD (CN) 2026-05-06 EP disclosed
EP-0008627-A2 Quinazoline derivatives, azo dyes derived from the quinazolines and their use as pigments BAYER AG (DE) 1980-03-19 EP disclosed
US-4150019-A COLORFAST, HEAT RESISTANT, MIGRATION HOECHST AKTIENGESELLSCHAFT (DE) 1979-04-17 US disclosed
US-4014863-A LACQUERS, PRINTING INKS, PAINTS BAYER AKTIENGESELLSCHAFT (DT) 1977-03-29 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 (1 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-20260132106-A1 FABP4/5 INHIBITORS, METHODS OF USE AND METHODS OF MAKING FABP5, FABP4, FABP1 NPC1 206/4885GAA 4229/4885HSP90AA1 923/4885

“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.