SCHEMBL4875898

SCHEMBL4875898

CCCc1cc2ccc(C(=O)O)cc2n1Cc1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.48
CCR2 P41597 1/20 0.46
ALOX5AP P20292 2/20 0.46
AGTR1 P30556 4/20 0.42
AGTR2 P50052 4/20 0.42
SLC22A12 Q96S37 1/20 0.42
NPC1 O15118 1/20 0.42
CASP3 P42574 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SENP8 Q96LD8 1/20 0.42
PTGES O14684 1/20 0.41
PTPN11 Q06124 1/20 0.41

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
SCHEMBL7423713 0.90 ALOX5AP (0.46) PPARGCCR2ALOX5AP
SCHEMBL7422217 0.89 CCR2 (0.46) CCR2ALOX5APNPC1CASP3RAB9A
SCHEMBL7422231 0.88 MAPT (0.47) PPARGNPC1RAB9APTGES
SCHEMBL7425963 0.86 AGTR1 (0.51) PPARGAGTR1AGTR2SMN1; SMN2
SCHEMBL5882169 0.83 CCR2 (0.50) PPARGCCR2ALOX5APSLC22A12NPC1
SCHEMBL6170375 0.80 AGTR1 (0.62) PPARGAGTR1AGTR2PTGES
SCHEMBL7425637 0.79 MAPT (0.48) PPARGCCR2NPC1RAB9A
SCHEMBL5882472 0.78 LMNA (0.46) PPARGCCR2NPC1SMN1; SMN2
SCHEMBL8006723 0.78 MAPT (0.44) PPARGCCR2ALOX5APNPC1RAB9A
SCHEMBL7419326 0.78 SLC22A12 (0.45) CCR2ALOX5APSLC22A12PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1624893-A2 INHIBITORS OF PHOSPHODIESTERASES IN INFERTILITY Applied Research Systems ARS Holding N.V. (AN) 2006-02-15 EP claimed
WO-2004087211-A2 INHIBITORS OF PHOSPHODIESTERASES IN INFERTILITY APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2004-10-14 WO claimed
EP-1877399-A1 TRIAZOLE DERIVATIVES AS VASOPRESSIN ANTAGONISTS Pfizer Limited (GB) 2008-01-16 EP disclosed
WO-2006114706-A1 TRIAZOLE DERIVATIVES AS VASOPRESSIN ANTAGONISTS PFIZER LIMITED (GB) 2006-11-02 WO disclosed
EP-1673355-A1 SUBSTITUTED TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS Pfizer Limited (GB) 2006-06-28 EP disclosed
EP-1572173-A1 ALPHA-2-DELTA LIGAND TO TREAT LOWER URINARY TRACT SYMPTOMS Warner-Lambert Company LLC (US) 2005-09-14 EP disclosed
EP-1562602-A2 IMMEDIATE RELEASE TOPICAL PHARMACEUTICAL FORMULATION FOR ENHANCEMENT OF FEMALE SEXUAL DESIRE AND RESPONSIVENESS Vivus, Inc. (US) 2005-08-17 EP disclosed
WO-2005028452-A1 SUBSTITUTED TRIAZOLE DERIVATIVES AS OXYTOCIN ANTAGONISTS PFIZER LIMITED (GB) 2005-03-31 WO disclosed
WO-2004054560-A1 ALPHA-2-DELTA LIGAND TO TREAT LOWER URINARY TRACT SYMPTOMS WARNER-LAMBERT COMPANY LLC (US) 2004-07-01 WO disclosed
WO-2004037262-A2 IMMEDIATE RELEASE TOPICAL PHARMACEUTICAL FORMULATION FOR ENHANCEMENT OF FEMALE SEXUAL DESIRE AND RESPONSIVENESS VIVUS, INC. (US) 2004-05-06 WO disclosed
US-6358992-B1 Method of inhibiting neoplastic cells with indole derivatives CELL PATHWAYS, INC. 2002-03-19 US disclosed
US-6069156-A Indole derivatives as cGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-05-30 US disclosed
EP-0820441-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-28 EP disclosed
WO-1996032379-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-17 WO disclosed