SCHEMBL18157746

SCHEMBL18157746

COC(=O)n1c(C)c(Br)c2cc(Br)ccc21

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.40
PLA2G2A P14555 1/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 2/20 0.39
BAZ2B Q9UIF8 1/20 0.39
NR4A2 P43354 1/20 0.38
MCL1 Q07820 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 3/20 0.37
POLB P06746 1/20 0.37
ALDH1A1 P00352 2/20 0.37
EGFR P00533 1/20 0.37
SRC P12931 1/20 0.37
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM4E B2RXH2 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36

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
SCHEMBL18160298 0.86 ELANE (0.41) ELANETSHRHSD17B10BAZ2BNR4A2
SCHEMBL18157744 0.81 GABRP (0.45) PLA2G2ATSHRHSD17B10NR4A2LMNA
SCHEMBL18943609 0.74 PDGFRA (0.39) ELANETSHRHSD17B10NR4A2LMNA
SCHEMBL855826 0.74 ALDH1A1 (0.40) HSD17B10LMNAMAPTPOLBALDH1A1
SCHEMBL18941218 0.72 CDK1 (0.49) BAZ2BLMNA
SCHEMBL31370521 0.72 KDM4E (0.43) PLA2G2ATSHRLMNAMAPTMAPK1
SCHEMBL23723352 0.71 CDK1 (0.47) BAZ2BLMNAMAPT
SCHEMBL31370553 0.71 GABRG2 (0.42) TSHRHSD17B10LMNAALDH1A1HPGD
SCHEMBL16741834 0.70 BAZ2B (0.41) ELANEPLA2G2ABAZ2BMCL1LMNA
SCHEMBL20699701 0.70 GABRG2 (0.39) LMNAMAPTPOLBALDH1A1NPC1

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-20180155286-A1 ANTIBIOTIC SENSITIVITY-RESTORING AND PHOTOSENSITIVE AGENTS NEW MEXICO TECH UNIVERSITY RESEARCH PARK CORPORATION 2018-06-07 US disclosed
US-9834514-B2 Antibiotic sensitivity-restoring and photosensitive agents NEW MEXICO TECH RESEARCH FOUNDATION (US) 2017-12-05 US disclosed
US-20160304453-A1 ANTIBIOTIC SENSITIVITY-RESTORING AND PHOTOSENSITIVE AGENTS NEW MEXICO TECH UNIVERSITY RESEARCH PARK CORPORATION 2016-10-20 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 (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-20180155286-A1 ANTIBIOTIC SENSITIVITY-RESTORING AND PHOTOSENSITIVE AGENTS XPA, PPOX, ALAD ELANE 737/4885PLA2G2A 2057/4885TSHR 4734/4885
US-20160304453-A1 ANTIBIOTIC SENSITIVITY-RESTORING AND PHOTOSENSITIVE AGENTS XPA, PPOX, ALAD ELANE 737/4885PLA2G2A 2057/4885TSHR 4734/4885

“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.