SCHEMBL16382913

SCHEMBL16382913

Cc1ccc2[nH]c(-c3ccc(Br)cc3)cc2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.60
KDM4E B2RXH2 6/20 0.56
MEN1 O00255 5/20 0.56
NPC1 O15118 5/20 0.56
RAB9A P51151 5/20 0.56
KMT2A Q03164 5/20 0.56
MAPT P10636 5/20 0.56
ALDH1A1 P00352 4/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
HPGD P15428 4/20 0.56
HSD17B10 Q99714 3/20 0.56
GFER P55789 1/20 0.56
LMNA P02545 4/20 0.49
MAPK1 P28482 1/20 0.49
ITK Q08881 2/20 0.46
MAOB P27338 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.45
PIN1 Q13526 1/20 0.44
DAO P14920 1/20 0.44
CA12 O43570 1/20 0.43

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
SCHEMBL16382914 0.89 RAB9A (0.63) CYP19A1KDM4EMEN1NPC1RAB9A
SCHEMBL16382924 0.83 KMT2A (0.62) CYP19A1KDM4EMEN1NPC1RAB9A
SCHEMBL18470546 0.83 CYP1A1 (0.57) CYP19A1KDM4EMEN1NPC1RAB9A
SCHEMBL2362656 0.82 NPC1 (0.69) CYP19A1KDM4EMEN1NPC1RAB9A
SCHEMBL18770082 0.82 NPC1 (0.68) CYP19A1KDM4EMEN1NPC1RAB9A
SCHEMBL11651810 0.80 KDM4E (0.67) KDM4EMEN1NPC1RAB9AKMT2A
SCHEMBL18845618 0.80 KDM4E (0.62) CYP19A1KDM4EMEN1NPC1RAB9A
SCHEMBL16382915 0.79 NPC1 (0.56) CYP19A1KDM4EMEN1NPC1RAB9A
SCHEMBL28281356 0.79 CYP19A1 (0.60) CYP19A1KDM4EMEN1NPC1RAB9A
SCHEMBL29047385 0.79 CYP1A1 (0.60) CYP19A1KDM4EMEN1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9334275-B2 Processes for preparing indoles NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2016-05-10 US disclosed
US-20150005494-A1 PROCESSES FOR PREPARING INDOLES NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2015-01-01 US 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-20150005494-A1 PROCESSES FOR PREPARING INDOLES IDO1, INMT, IDO2 CYP19A1 318/4885KDM4E 2552/4885MEN1 1573/4885

“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.