SCHEMBL3754878

SCHEMBL3754878

[C]#Cc1ccccc1[N+](=O)[O-]

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.48
TDP1 Q9NUW8 5/20 0.46
ALDH1A1 P00352 8/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
GPR35 Q9HC97 1/20 0.45
S100A4 P26447 2/20 0.44
HPGD P15428 1/20 0.44
PLAU P00749 1/20 0.44
PTPRC P08575 1/20 0.44
TSHR P16473 2/20 0.44
NPC1 O15118 1/20 0.42
RECQL P46063 1/20 0.42
RAB9A P51151 1/20 0.42
MAPK1 P28482 2/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL12286918 0.82 HSD17B10 (0.52) HSD17B10TDP1ALDH1A1MEN1KMT2A
SCHEMBL25310 0.80 HSD17B10 (0.50) HSD17B10TDP1ALDH1A1MEN1KMT2A
SCHEMBL29382907 0.78 VCAM1 (0.56) HSD17B10TDP1ALDH1A1MEN1KMT2A
SCHEMBL5671061 0.78 HSD17B10 (0.54) HSD17B10TDP1ALDH1A1MEN1KMT2A
SCHEMBL29595518 0.78 HSD17B10 (0.48) HSD17B10TDP1ALDH1A1MEN1KMT2A
SCHEMBL562027 0.78 HSD17B10 (0.48) HSD17B10TDP1ALDH1A1MEN1KMT2A
SCHEMBL56638 0.78 VCAM1 (0.56) HSD17B10TDP1ALDH1A1MEN1KMT2A
SCHEMBL10870335 0.78 KMT2A (0.50) HSD17B10TDP1ALDH1A1MEN1KMT2A
SCHEMBL11055565 0.78 HSD17B10 (0.48) HSD17B10TDP1ALDH1A1MEN1KMT2A
SCHEMBL11684809 0.78 HSD17B10 (0.48) HSD17B10TDP1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7408060-B2 Nonsteroidal progesterone receptor modulators SCHERING AG (DE) 2008-08-05 US claimed
EP-1902049-A2 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS Bayer Schering Pharma Aktiengesellschaft (DE) 2008-03-26 EP claimed
EP-1899315-A1 BENZOFURANONE DERIVATIVES AS NONSTEROIDAL PROGESTERONE RECEPTOR MODULATORS Schering Aktiengesellschaft (DE) 2008-03-19 EP claimed
US-20070142464-A1 Nonsteroidal progesterone receptor modulators SCHERING AG (DE) 2007-06-21 US claimed
US-20070010514-A1 Non-steroidal progesterone receptor modulators BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-11 US claimed
WO-2006136462-A1 BENZOFURANONE DERIVATIVES AS NONSTEROIDAL PROGESTERONE RECEPTOR MODULATORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-12-28 WO claimed
WO-2006136461-A2 NON-STEROIDAL PROGESTERONE RECEPTOR MODULATORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-12-28 WO claimed
EP-2029570-B1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2014-10-15 EP disclosed
US-8324204-B2 Fused thiophene derivatives as kinase inhibitors UCB PHARMA SA (BE) 2012-12-04 US disclosed
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-12-02 US disclosed
WO-2009122148-A1 FUSED THIOPHENE AND THIAZOLE DERIVATIVES AS PI3K KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-10-08 WO disclosed
WO-2009071890-A1 TRICYCLIC KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071895-A1 FUSED THIAZOLE AND THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
EP-2029570-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-03-04 EP disclosed
WO-2007141504-A1 FUSED THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2007-12-13 WO disclosed
EP-0240890-B1 Prostacyclin (PGI2) analogues SHIONOGI & CO (JP) 1993-11-18 EP disclosed
US-4855449-A Prostacyclin (PGI2) analogues SHIONOGI & CO., LTD. (JP) 1989-08-08 US disclosed
US-4820836-A ANTICOAGULANTS, ANTIULCER AGENTS SHIONOGI & CO., LTD. (JP) 1989-04-11 US disclosed
EP-0240890-A2 Prostacyclin (PGI2) analogues SHIONOGI & CO., LTD. (JP) 1987-10-14 EP 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 (3 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-20070010514-A1 Non-steroidal progesterone receptor modulators PGR, PGRMC1, CYP19A1 HSD17B10 364/4885TDP1 3156/4885ALDH1A1 1444/4885
US-20100305066-A1 Fused Thiophene Derivatives as Kinase Inhibitors PIKFYVE, PI4KA, PIK3CA HSD17B10 2922/4885TDP1 494/4885ALDH1A1 3061/4885
US-20070142464-A1 Nonsteroidal progesterone receptor modulators PGR, PGRMC1, PGRMC2 HSD17B10 447/4885TDP1 3346/4885ALDH1A1 1023/4885

“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.