SCHEMBL9294181

SCHEMBL9294181

Nc1ccc2ccccc2c1Cc1c(N)ccc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 5/20 0.57
CYP1A2 P05177 3/20 0.57
CYP2C9 P11712 2/20 0.57
CYP2C19 P33261 2/20 0.57
ALDH1A1 P00352 5/20 0.50
TSHR P16473 2/20 0.50
HPGD P15428 2/20 0.50
CYP3A4 P08684 1/20 0.50
KEAP1 Q14145 1/20 0.50
KDM4E B2RXH2 3/20 0.48
GAA P10253 2/20 0.48
MAPT P10636 2/20 0.48
TAAR1 Q96RJ0 1/20 0.48
TDP1 Q9NUW8 2/20 0.48
CYP2A6 P11509 1/20 0.48
HPRT1 P00492 2/20 0.47
HTR2A P28223 1/20 0.45
HIF1A Q16665 2/20 0.41
CYP1B1 Q16678 1/20 0.41
GLA P06280 1/20 0.40

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
SCHEMBL29625674 1.00 HSD17B10 (0.57) HSD17B10CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL29625694 0.89 HSD17B10 (0.79) HSD17B10CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL23515204 0.89 HSD17B10 (0.79) HSD17B10CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL4931272 0.88 HSD17B10 (0.46) HSD17B10CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL10751032 0.84 ALDH1A1 (0.62) HSD17B10CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL23515356 0.84 IDO1 (0.51) HPGDKDM4EMAPTPOLB
SCHEMBL29625649 0.84 IDO1 (0.51) HPGDKDM4EMAPTPOLB
SCHEMBL11842789 0.83 HSD17B10 (0.46) HSD17B10CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL1161044 0.83 ALDH1A1 (0.46) HSD17B10CYP1A2CYP2C9CYP2C19ALDH1A1
SCHEMBL11841719 0.83 ALDH1A1 (0.50) HSD17B10CYP1A2CYP2C9CYP2C19ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230015875-A1 Ion Channel Antagonists/Blockers and Uses Thereof SHANGHAI EAST HOSPITAL (CN) 2023-01-19 US disclosed
US-5362822-A Epoxy resin for polyurethane having enhanced mechanical properties THE DOW CHEMICAL COMPANY (US) 1994-11-08 US disclosed
EP-0568908-A2 Polyvalent epoxy compounds BASF Lacke + Farben AG (DE) 1993-11-10 EP disclosed
US-5189117-A Tensile strength, tear strength, waterproofing THE DOW CHEMICAL COMPANY (US) 1993-02-23 US disclosed
US-4792404-A USING CHLORINE-RESISTANT POLYAMIDE MEMBRANE ALLIED-SIGNAL INC. (US) 1988-12-20 US disclosed
US-4699933-A Polyurethanes containing triazine or both triazine and oxazoline, triazine and imino carbamate or triazine and other N-heterocyclic groups THE DOW CHEMICAL COMPANY (US) 1987-10-13 US disclosed
US-4555553-A HIGH STRENGTH; HEAT RESISTANCE THE DOW CHEMICAL COMPANY (US) 1985-11-26 US disclosed
US-4555554-A FROM EPOXY RESIN AND MONOUNSATURATED MONOCAR-BOXYLIC ACID THE DOW CHEMICAL COMPANY (US) 1985-11-26 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-20230015875-A1 Ion Channel Antagonists/Blockers and Uses Thereof CACNA1F, CACNA1S, CACNA1D HSD17B10 1342/4885CYP1A2 955/4885CYP2C9 879/4885

“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.