SCHEMBL18907355

SCHEMBL18907355

Nc1c(-c2ccc(Br)c3ccccc23)ccc2ccccc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
HSD17B10 Q99714 4/20 0.41
TSHR P16473 2/20 0.41
CYP2A6 P11509 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NCEH1 Q6PIU2 1/20 0.39
DNMT1 P26358 1/20 0.39
HPGD P15428 2/20 0.39
CYP3A4 P08684 1/20 0.39
KEAP1 Q14145 1/20 0.39
MEN1 O00255 3/20 0.39
MAPT P10636 3/20 0.39
KMT2A Q03164 3/20 0.39
POLB P06746 2/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
CYP1A2 P05177 1/20 0.39
GLA P06280 1/20 0.39
ATM Q13315 1/20 0.39
HPRT1 P00492 2/20 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
SCHEMBL6062322 0.85 ALDH1A1 (0.55) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL29705759 0.85 ALDH1A1 (0.55) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL24432943 0.82 ALDH1A1 (0.48) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL30843336 0.82 ALDH1A1 (0.48) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL29481102 0.81 ALDH1A1 (0.50) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL692053 0.81 ALDH1A1 (0.50) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL28613236 0.80 ALDH1A1 (0.46) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL29490404 0.79 CYP1A2 (0.52) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL947346 0.79 CYP1A2 (0.52) ALDH1A1HSD17B10TSHRCYP2A6TDP1
SCHEMBL13631978 0.78 CYP1A2 (0.47) ALDH1A1MEN1MAPTKMT2APOLB

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-20170155057-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 US disclosed
US-20170155057-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 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-20170155057-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, OCIAD1, CCNT1 ALDH1A1 195/4885HSD17B10 1468/4885TSHR 4639/4885

“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.