SCHEMBL162962

SCHEMBL162962

O=C(Nc1ccc(Cl)cc1)Nc1ccc(C(F)(F)F)c(Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.67
MEN1 O00255 4/20 0.66
KMT2A Q03164 4/20 0.66
LMNA P02545 3/20 0.66
EPHX2 P34913 3/20 0.66
EPHX1 P07099 2/20 0.66
NPC1 O15118 2/20 0.66
HTT P42858 2/20 0.66
ADORA3 P0DMS8 1/20 0.66
CHRM1 P11229 1/20 0.66
SLC6A2 P23975 1/20 0.66
PDE4A P27815 1/20 0.66
ADRA1A P35348 1/20 0.66
OPRM1 P35372 1/20 0.66
PDE3A Q14432 1/20 0.66
NLRP3 Q96P20 1/20 0.66
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
CA7 P43166 2/20 0.56
CA9 Q16790 2/20 0.56

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
SCHEMBL4556067 0.94 KDR (0.75) KDRMEN1KMT2ALMNAEPHX2
SCHEMBL11185513 0.89 KDR (0.65) KDRMEN1KMT2ALMNAEPHX2
Cloflucarban SCHEMBL119821 0.88 KDR (0.88) KDRMEN1KMT2ALMNAEPHX2
Cloflucarban SCHEMBL27537485 0.88 KDR (0.88) KDRMEN1KMT2ALMNAEPHX2
SCHEMBL10220062 0.88 KDR (0.88) KDREPHX2EPHX1CA1CA2
Cloflucarban SCHEMBL28866649 0.87 KDR (0.80) KDRMEN1KMT2ALMNAEPHX2
SCHEMBL4548244 0.85 SMN1; SMN2 (0.67) KDRMEN1KMT2ALMNAEPHX2
SCHEMBL11831657 0.84 KDR (0.62) KDRMEN1KMT2ALMNAEPHX2
SCHEMBL9524746 0.84 CA2 (0.53) KDRMEN1KMT2ALMNAEPHX2
SCHEMBL665533 0.82 KDR (0.67) KDRMEN1KMT2ALMNAHTT

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 1020 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2916820-B1 DELIVERY OF BIOLOGICALLY-ACTIVE AGENTS USING VOLATILE, HYDROPHOBIC SOLVENTS ROCHAL TECH LLC (US) 2023-10-11 EP claimed
EP-3677251-B1 WATER-IN-OIL EMULSION-TYPE STICK-LIKE DEODORANT AGENT SHINETSU CHEMICAL CO (JP) 2023-08-16 EP claimed
US-11547643-B2 Water-in-oil emulsion-type stick-shaped deodorant composition SHTN-ETSU CHEMICAL CO., LTD. (JP) 2023-01-10 US claimed
WO-2021054927-A2 GLUTATHIONE-CHOLESTEROL DERIVATIVES AS BRAIN TARGETING AGENTS SOUTH DAKOTA BOARD OF REGENTS (US) 2021-03-25 WO claimed
EP-3263145-B1 ANTIMICROBIAL COMPOSITIONS AND METHODS FOR LOCKING CATHETERS BECTON DICKINSON CO (US) 2021-01-20 EP claimed
US-20200253843-A1 WATER-IN-OIL EMULSION-TYPE STICK-SHAPED DEODORANT COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-08-13 US claimed
EP-3677251-A1 WATER-IN-OIL EMULSION-TYPE STICK-LIKE DEODORANT AGENT Shin-Etsu Chemical Co., Ltd. (JP) 2020-07-08 EP claimed
US-20200048305-A1 GLUTATHIONE-CHOLESTEROL DERIVATIVES AS BRAIN TARGETING AGENTS SOUTH DAKOTA BOARD OF REGENTS (US) 2020-02-13 US claimed
CN-109862877-A Cosmetics for skin 花王株式会社 2019-06-07 CN claimed
CN-109640927-A The composition for dermal delivery comprising nano-emulsion and modified layered double hydroxide H&A帕玛科株式会社 2019-04-16 CN claimed
EP-0506207-B1 Pharmaceutical vehicles for reducing transdermal flux ACCESS PHARMA INC (US) 1999-11-17 EP claimed
WO-1999045771-A1 TISSUE PAPER HAVING ANTIMICROBIAL SKIN LOTION THE PROCTER & GAMBLE COMPANY (US) 1999-09-16 WO claimed
US-5891914-A COMPLEX OF ORGANOSILICON COMPOUND AND ACTIVE MATERIALS SPECIAL ADVANCED BIOMATERIALS, INC. (US) 1999-04-06 US claimed
EP-0872248-A2 Pharmaceutical vehicles for reducing transdermal flux Access Pharmaceuticals, Inc. (US) 1998-10-21 EP claimed
WO-1992017184-A2 BIOACTIVE TOPICAL SILOXANE COMPOSITIONS HAVING ENHANCED PERFORMANCE AND SAFETY SPECIAL ADVANCED BIOMATERIALS, INC. (US) 1992-10-15 WO claimed
EP-0506207-A2 Pharmaceutical vehicles for reducing transdermal flux CHEMEX PHARMACEUTICALS, Inc. (US) 1992-09-30 EP claimed
US-4895727-A Using water soluble zinc compound CHEMEX PHARMACEUTICALS, INC. (US) 1990-01-23 US claimed
EP-0215072-A4 ANTISEPTIC FLUIDS. GLUCK BRUNO A 1990-01-08 EP claimed
EP-0215072-A1 ANTISEPTIC FLUIDS GLUCK, Bruno Anthony (AU) 1987-03-25 EP claimed
WO-1986005391-A1 ANTISEPTIC FLUIDS GLUCK BRUNO A (AU) 1986-09-25 WO claimed

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-20200048305-A1 GLUTATHIONE-CHOLESTEROL DERIVATIVES AS BRAIN TARGETING AGENTS GSTK1, GSTO1, GSTM2 KDR 1275/4885MEN1 1607/4885KMT2A 3630/4885

“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.