SCHEMBL23946289

SCHEMBL23946289

CCc1nc(-c2ccc3ccccc3c2)c2cccc(-c3ccccc3)c2n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 4/20 0.43
ADORA2A P29274 4/20 0.38
ADORA1 P30542 3/20 0.38
ENPP1 P22413 2/20 0.36
ACACA Q13085 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C8 P10632 1/20 0.36
CYP2C9 P11712 1/20 0.36
DHODH Q02127 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
CNR2 P34972 1/20 0.36
MAPK9 P45984 1/20 0.36
MAPK10 P53779 1/20 0.36
CSNK1D P48730 1/20 0.36
MAPK11 Q15759 1/20 0.36
MAPK14 Q16539 1/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
HSD17B1 P14061 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
SCHEMBL23946294 0.88 CRHR1 (0.45) CRHR1ENPP1CYP3A4CYP2C8CYP2C9
SCHEMBL23946296 0.81 ALDH1A1 (0.39) CRHR1ADORA2AENPP1ALDH1A1MAPT
SCHEMBL20344283 0.81 ADORA2A (0.42) ADORA2AADORA1DHODHALDH1A1
SCHEMBL23776019 0.76 ADORA2A (0.43) ADORA2AADORA1ALDH1A1MAPT
SCHEMBL25680707 0.73 CYP11B1 (0.38) CRHR1ACACACYP3A4CYP2C9PPARG
SCHEMBL22606758 0.72 ALDH1A1 (0.37) CRHR1ADORA2AADORA1ENPP1CYP3A4
SCHEMBL25649500 0.71 ENPP1 (0.50) ADORA2AADORA1ENPP1ACACACYP2C9
SCHEMBL21934938 0.71 MEN1 (0.41) CRHR1ADORA2AADORA1ENPP1CYP3A4
SCHEMBL25680693 0.71 CA12 (0.40) ENPP1CYP3A4CYP2C9ALDH1A1MAPT
SCHEMBL13078980 0.71 ADORA2A (0.54) ADORA2AADORA1ALDH1A1MAPK9MAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210328153-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES Beijing Summer Sprout Technology Co., Ltd. (CN) 2021-10-21 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-20210328153-A1 ELECTROLUMINESCENT MATERIALS AND DEVICES IDO1, IDO2, AZI2 CRHR1 3261/4885ADORA2A 333/4885ADORA1 1072/4885

“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.