SCHEMBL19600443

SCHEMBL19600443

Oc1cc(Cl)ccc1-c1ccc(Br)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 2/20 0.46
HSD17B10 Q99714 4/20 0.42
ALDH1A1 P00352 3/20 0.42
TSHR P16473 2/20 0.42
CYP3A4 P08684 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
S100A4 P26447 2/20 0.40
HSP90AA1 P07900 1/20 0.40
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
HPGD P15428 2/20 0.36
ALOX15 P16050 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
HIF1A Q16665 1/20 0.36
TMPRSS4 Q9NRS4 1/20 0.36
ALOX12 P18054 1/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
AHR P35869 1/20 0.35

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
SCHEMBL17265422 0.84 CXCR2 (0.43) CXCR2HSD17B10ALDH1A1TSHRCYP3A4
SCHEMBL17373444 0.80 ALDH1A1 (0.43) HSD17B10ALDH1A1CYP3A4TDP1CA2
SCHEMBL17879894 0.80 GRM2 (0.46) ALDH1A1CYP3A4S100A4CA1CA2
SCHEMBL16282222 0.80 S100A4 (0.39) TSHRS100A4CA1CA2ALOX12
SCHEMBL24972563 0.79 S100A4 (0.46) HSD17B10ALDH1A1TSHRS100A4HPGD
SCHEMBL30223443 0.79 S100A4 (0.46) HSD17B10ALDH1A1TSHRS100A4HPGD
SCHEMBL16219704 0.77 SLC22A12 (0.37) S100A4MEN1KMT2ATMPRSS4AHR
SCHEMBL13631978 0.77 CYP1A2 (0.47) ALDH1A1MEN1KMT2AMAPK1CASP3
SCHEMBL339112 0.77 HSD17B10 (0.65) HSD17B10ALDH1A1TSHRCYP3A4TDP1
SCHEMBL13631896 0.77 CYP1A2 (0.47) ALDH1A1MEN1KMT2AMAPK1CASP3

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-20170331051-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-16 US disclosed
US-20170331051-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-16 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-20170331051-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, AOX1 CXCR2 3915/4885HSD17B10 1564/4885ALDH1A1 7/4885

“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.