SCHEMBL1027443

SCHEMBL1027443

N#Cc1ccc(-c2ccccc2)c(N)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.53
KDM4E B2RXH2 3/20 0.53
GAA P10253 2/20 0.53
HSD17B10 Q99714 3/20 0.48
EGLN2 Q96KS0 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.45
ADORA2A P29274 3/20 0.45
ADORA1 P30542 2/20 0.45
CYP19A1 P11511 3/20 0.44
TSHR P16473 1/20 0.43
HPGD P15428 2/20 0.42
ADRA2C P18825 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
METAP2 P50579 1/20 0.41
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
USP2 O75604 1/20 0.40
ESR1 P03372 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL698158 0.85 PTGDR2 (0.49) ALDH1A1KDM4EGAAHSD17B10PTGDR2
SCHEMBL3422472 0.82 PTGDR2 (0.53) PTGDR2CYP19A1TSHRADRA2CMEN1
SCHEMBL29430712 0.81 GABRG2 (0.46) ALDH1A1KDM4EGAAEGLN2ADORA2A
SCHEMBL28757167 0.81 ALDH1A1 (0.48) ALDH1A1KDM4EGAAHSD17B10ADORA2A
SCHEMBL22636969 0.80 CYP11B2 (0.58) KDM4EGAAADORA2AADORA1CYP19A1
SCHEMBL996126 0.78 PTGDR2 (0.50) ALDH1A1PTGDR2CYP19A1TSHRMEN1
SCHEMBL5633361 0.78 STS (0.54) ALDH1A1KDM4EGAAPTGDR2CYP19A1
SCHEMBL12855308 0.78 PTGDR2 (0.50) PTGDR2CYP19A1TSHRADRA2CMEN1
SCHEMBL20740894 0.78 PTGDR2 (0.50) PTGDR2CYP19A1TSHRADRA2CMEN1
SCHEMBL31741946 0.78 PTGDR2 (0.50) ALDH1A1PTGDR2CYP19A1TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118878873-A Liquid crystal elastic network@liquid metal nanoparticle, preparation method and application 四川大学 2024-11-01 CN claimed
CN-115785131-B Method for synthesizing high-efficiency luminescent complex material with tunable luminescent wavelength 五邑大学 2024-05-17 CN claimed
EP-0463931-B1 Amorphous copolymers, translucent to visible light, for applications in non linear optics THOMSON CSF (FR) 1996-04-24 EP claimed
CN-118878873-A Liquid crystal elastic network@liquid metal nanoparticle, preparation method and application 四川大学 2024-11-01 CN disclosed
EP-3966196-A1 PHENYL-SULFAMOYL.BENZOYC ACIDS AS ERAP1 MODULATORS Grey Wolf Therapeutics Limited (GB) 2022-03-16 EP disclosed
WO-2020225569-A1 PHENYL-SULFAMOYL.BENZOYC ACIDS AS ERAP1 MODULATORS Grey Wolf Therapeutics Limited (GB) 2020-11-12 WO disclosed
US-9708340-B2 Urea derivatives and their use as fatty-acid binding protein (FABP) inhibitors HOFFMANN-LA ROCHE INC. (US) 2017-07-18 US disclosed
US-20160185795-A1 UREA DERIVATIVES AND THEIR USE AS FATTY-ACID BINDING PROTEIN (FABP) INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2016-06-30 US disclosed
CN-103037969-B Complex compound Johnson Matthey Public Co.,Ltd. (GB) 2015-07-29 CN disclosed
WO-2014146994-A1 UREA DERIVATIVES AND THEIR USE AS FATTY-ACID BINDING PROTEIN (FABP) INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2014-09-25 WO disclosed
US-8513235-B2 Homocysteine synthase inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-08-20 US disclosed
EP-2275404-A1 HOMOCYSTEINE SYNTHASE INHIBITOR Mitsubishi Tanabe Pharma Corporation (JP) 2011-01-19 EP disclosed
EP-1817288-A4 DUAL ANTIPLATELET/ANTICOAGULANT PYRIDOXINE ANALOGS MEDICURE INT INC (BB) 2009-08-26 EP disclosed
EP-1817288-A1 DUAL ANTIPLATELET/ANTICOAGULANT PYRIDOXINE ANALOGS Medicure International Inc. (BB) 2007-08-15 EP disclosed
WO-2006050598-A1 DUAL ANTIPLATELET/ANTICOAGULANT PYRIDOXINE ANALOGS MEDICURE INTERNATIONAL INC. (CA) 2006-05-18 WO disclosed
US-5547966-A Aryl urea and related compounds BRISTOL-MYERS SQUIBB COMPANY (US) 1996-08-20 US disclosed
EP-0463931-B1 Amorphous copolymers, translucent to visible light, for applications in non linear optics THOMSON CSF (FR) 1996-04-24 EP disclosed
EP-0656350-A1 Biaryl urea and related compounds BRISTOL-MYERS SQUIBB COMPANY (US) 1995-06-07 EP disclosed
US-5264512-A Amorphous copolymers, transparent in the visible range, for non-linear optical applications THOMSON-CSF (FR) 1993-11-23 US disclosed
EP-0463931-A1 Amorphous copolymers, translucent to visible light, for applications in non linear optics THOMSON-CSF (FR) 1992-01-02 EP 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-20160185795-A1 UREA DERIVATIVES AND THEIR USE AS FATTY-ACID BINDING PROTEIN (FABP) INHIBITORS FABP1, FABP5, FABP2 ALDH1A1 689/4885KDM4E 3467/4885GAA 3457/4885

“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.