SCHEMBL7415811

SCHEMBL7415811

OC1CCc2[nH]c3ccc(Oc4ccc(Cl)cc4)cc3c2C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 5/20 0.50
HTR1D P28221 4/20 0.50
EGFR P00533 1/20 0.43
IGF1R P08069 1/20 0.43
FLT4 P35916 1/20 0.43
KDR P35968 1/20 0.43
SIRT1 Q96EB6 1/20 0.43
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
RECQL P46063 1/20 0.39
PMP22 Q01453 1/20 0.39
HSD17B10 Q99714 1/20 0.39
HTR1A P08908 1/20 0.38

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
SCHEMBL7412246 0.88 HTR1B (0.53) HTR1BHTR1DEGFRIGF1RFLT4
SCHEMBL7409510 0.86 SIRT1 (0.55) HTR1BHTR1DSIRT1KMT2AMEN1
SCHEMBL7410152 0.85 HTR1D (0.50) HTR1BHTR1DEGFRIGF1RFLT4
SCHEMBL11730607 0.84 SIRT1 (0.45) HTR1BHTR1DSIRT1KMT2AMEN1
SCHEMBL4288837 0.82 HTR1D (0.72) HTR1BHTR1DKDRSIRT1KMT2A
SCHEMBL7412220 0.79 KMT2A (0.60) HTR1BHTR1DEGFRIGF1RFLT4
SCHEMBL7407819 0.79 KMT2A (0.44) HTR1BHTR1DSIRT1KMT2AMEN1
SCHEMBL7412705 0.75 L3MBTL1 (0.51) HTR1BHTR1DSIRT1KMT2AMEN1
SCHEMBL7409267 0.74 HTR6 (0.41) HTR1BHTR1DEGFRIGF1RFLT4
SCHEMBL7407748 0.74 HTR1D (0.51) HTR1BHTR1DKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4257952-A PSYCHOTROPIC DRUGS, ANALGESICS, ANTIHISTAMINES STERLING DRUG INC. (US) 1981-03-24 US disclosed
US-4172834-A ANALGESICS, ANTIHISTAMINES AND PSYCHOTROPIC AGENTS STERLING DRUG INC. (US) 1979-10-30 US disclosed
US-3959309-A ANALGESICS, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1976-05-25 US disclosed