SCHEMBL5597305

SCHEMBL5597305

CCCCCC(=O)c1ccc(OCc2ccc(Br)cc2)c(C(CCC)c2ncc[nH]2)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.40
THRA P10827 6/20 0.38
THRB P10828 5/20 0.38
SMPD1 P17405 2/20 0.37
CYSLTR2 Q9NS75 1/20 0.36
CYSLTR1 Q9Y271 1/20 0.36
EGFR P00533 1/20 0.36
VCP P55072 1/20 0.35
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B3 P37058 1/20 0.34
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34

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
SCHEMBL4640765 0.93 FPR2 (0.40) FPR2THRATHRBSMPD1EGFR
SCHEMBL4642228 0.89 FPR2 (0.44) FPR2THRBSMPD1RXRARXRB
SCHEMBL6437508 0.83 FPR2 (0.47) FPR2SMPD1NPC1HPGDRAB9A
SCHEMBL5597310 0.82 FPR2 (0.44) FPR2SMPD1RXRARXRB
SCHEMBL4642066 0.78 CCR5 (0.39) FPR2VCP
SCHEMBL5597306 0.77 SMPD1 (0.41) THRATHRBSMPD1HSD17B3
SCHEMBL2351912 0.77 ALDH1A1 (0.41) THRATHRBSMPD1HPGD
SCHEMBL4642685 0.76 FPR2 (0.47) FPR2SMPD1NPC1HPGDRAB9A
SCHEMBL4640767 0.76 SMPD1 (0.41) THRATHRBSMPD1
SCHEMBL5597243 0.75 HSD17B3 (0.46) FPR2HSD17B3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1804819-A4 USE OF AROMATASE INHIBITORS FOR ENDOMETRIAL THINNING IN PREPARATION FOR SURGICAL PROCEDURES ON THE ENDOMETRIAL CAVITY AND UTERUS UNIV WAYNE STATE (US) 2007-12-12 EP disclosed
EP-1804819-A2 USE OF AROMATASE INHIBITORS FOR ENDOMETRIAL THINNING IN PREPARATION FOR SURGICAL PROCEDURES ON THE ENDOMETRIAL CAVITY AND UTERUS WAYNE STATE UNIVERSITY (US) 2007-07-11 EP disclosed
WO-2006041939-A2 USE OF AROMATASE INHIBITORS FOR ENDOMETRIAL THINNING IN PREPARATION FOR SURGICAL PROCEDURES ON THE ENDOMETRIAL CAVITY AND UTERUS WAYNE STATE UNIVERSITY (US) 2006-04-20 WO disclosed
EP-1492515-A1 PHARMACEUTICAL COMPOSITION COMPRISING AN AROMATASE INHIBITOR AND AN ESTROGEN SUITABLE FOR HORMONE REPLACEMENT THERAPY FOR A MALE JENCAP RESEARCH LTD. (CA) 2005-01-05 EP disclosed
WO-2003082254-A1 PHARMACEUTICAL COMPOSITION COMPRISING AN AROMATASE INHIBITOR AND AN ESTROGEN SUITABLE FOR HORMONE REPLACEMENT THERAPY FOR A MALE JENCAP RESEARCH LTD. (CA) 2003-10-09 WO disclosed