SCHEMBL8239652

SCHEMBL8239652

COC(=O)C(Cc1ccccc1)n1ccc2cc(N)ccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTSR1 P30989 1/20 0.41
HSD17B10 Q99714 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
MAPT P10636 3/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 1/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
PTPN7 P35236 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RAB9A P51151 3/20 0.39
HDAC8 Q9BY41 2/20 0.39
NPC1 O15118 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
SCHEMBL28771761 0.88 HSD17B10 (0.50) NTSR1HSD17B10NPSR1MAPTKMT2A
SCHEMBL3198138 0.85 HSD17B10 (0.42) NTSR1HSD17B10NPSR1MAPTKMT2A
SCHEMBL3193529 0.82 ITGA4 (0.43) NPSR1MAPTKMT2AMEN1L3MBTL1
SCHEMBL13319074 0.81 NR3C2 (0.41) MAPTKMT2AMEN1RAB9ANPC1
SCHEMBL16144683 0.72 MEN1 (0.46) HSD17B10NPSR1MAPTKMT2AMEN1
SCHEMBL13319075 0.71 BRPF1 (0.43) NTSR1HSD17B10NPSR1MAPTKMT2A
SCHEMBL16984754 0.71 NPSR1 (0.68) HSD17B10NPSR1MAPTKMT2AMEN1
SCHEMBL16753139 0.70 MAPK14 (0.50) KMT2ARAB9ANPC1
SCHEMBL27658305 0.69 NTSR1 (0.42) NTSR1HSD17B10NPSR1SLC6A2SLC6A4
SCHEMBL1995445 0.69 SRD5A2 (0.52) KMT2AMEN1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137363-A1 Substituted Indoles And Methods Of Their Use WYETH LLC (US) 2010-06-03 US disclosed
US-20100137363-A1 Substituted Indoles And Methods Of Their Use WYETH LLC (US) 2010-06-03 US disclosed
US-7683091-B2 Substituted indoles and methods of their use WYETH (US) 2010-03-23 US disclosed
US-7683091-B2 Substituted indoles and methods of their use WYETH (US) 2010-03-23 US disclosed
US-20070043101-A1 Substituted indoles and methods of their use WYETH (US) 2007-02-22 US disclosed
US-20070043101-A1 Substituted indoles and methods of their use WYETH (US) 2007-02-22 US disclosed
WO-2007022321-A2 SUBSTITUTED INDOLES AND USE THEREOF WYETH (US) 2007-02-22 WO 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 (2 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-20070043101-A1 Substituted indoles and methods of their use INMT, AANAT, IDO2 NTSR1 411/4885HSD17B10 1689/4885NPSR1 109/4885
US-20100137363-A1 Substituted Indoles And Methods Of Their Use INMT, AANAT, IDO2 NTSR1 411/4885HSD17B10 1689/4885NPSR1 109/4885

“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.