SCHEMBL9499200

SCHEMBL9499200

CCc1cc(Cl)cc([N+](=O)[O-])c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.48
POLB P06746 1/20 0.48
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 3/20 0.42
CYP19A1 P11511 1/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 1/20 0.38
S1PR4 O95977 1/20 0.38
GPR35 Q9HC97 1/20 0.38
CYP2D6 P10635 1/20 0.37
NPC1 O15118 1/20 0.37
MAPT P10636 2/20 0.37

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
SCHEMBL5495288 0.86 HTT (0.57) HTTPOLBALDH1A1TSHRCYP19A1
SCHEMBL9570744 0.86 HTT (0.57) HTTPOLBALDH1A1TDP1TSHR
SCHEMBL29796201 0.82 TSHR (0.56) HTTPOLBALDH1A1TDP1TSHR
SCHEMBL14784786 0.82 TSHR (0.56) HTTPOLBALDH1A1TDP1TSHR
SCHEMBL11442603 0.81 TSHR (0.55) HTTPOLBALDH1A1TSHRCYP19A1
SCHEMBL4926495 0.81 ALDH1A1 (0.46) HTTPOLBALDH1A1TDP1TSHR
SCHEMBL8999894 0.81 ALDH1A1 (0.46) HTTPOLBALDH1A1TDP1TSHR
SCHEMBL30313059 0.81 LOXL2 (0.52) HTTPOLBALDH1A1TDP1TSHR
SCHEMBL3912806 0.81 ALDH1A1 (0.46) HTTPOLBALDH1A1TDP1TSHR
SCHEMBL31366655 0.81 ALDH1A1 (0.46) HTTPOLBALDH1A1TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932284-B2 Indole sulfonamide modulators of progesterone receptors ELI LILLY AND COMPANY (US) 2011-04-26 US disclosed
US-20090069400-A1 Indole Sulfonamide Modulators of Progesterone Receptors ELI LILLY AND COMPANY 2009-03-12 US disclosed
EP-0303387-B1 KYNURENIC ACID DERIVATIVES USEFUL IN THE TREATMENT OF NEURODEGENERATIVE DISORDERS MERCK SHARP & DOHME LTD. (GB) 1993-04-21 EP disclosed
EP-0303387-A1 Kynurenic acid derivatives useful in the treatment of neurodegenerative disorders MERCK SHARP & DOHME LTD. (GB) 1989-02-15 EP disclosed
US-3941717-A Process for the production of a catalyst comprising a novel metal on activated carbon DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DT) 1976-03-02 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-20090069400-A1 Indole Sulfonamide Modulators of Progesterone Receptors PGR, NPSR1, PRLHR HTT 4087/4885POLB 4449/4885ALDH1A1 837/4885

“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.