SCHEMBL23958345

SCHEMBL23958345

COc1ccc2c(=O)n(-c3ccccc3)c(Nc3cccnc3)nc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
G6PD P11413 1/20 0.53
CYP19A1 P11511 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.46
CYP1A2 P05177 3/20 0.46
CYP3A4 P08684 3/20 0.46
USP2 O75604 3/20 0.46
ALDH1A1 P00352 3/20 0.46
CYP2C9 P11712 2/20 0.46
TSHR P16473 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP2C19 P33261 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
ALOX12 P18054 1/20 0.45
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
GABRA1 P14867 1/20 0.43
GABRG2 P18507 1/20 0.43
GABRB3 P28472 1/20 0.43
GABRA5 P31644 1/20 0.43

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
SCHEMBL24110979 0.93 CYP19A1 (0.52) G6PDCYP19A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL24090110 0.87 G6PD (0.48) G6PDCYP19A1SMN1; SMN2CYP1A2CYP3A4
SCHEMBL23958124 0.86 MDM2 (0.51) G6PDSMN1; SMN2ALDH1A1ALOX12
SCHEMBL24110995 0.85 ALOX12 (0.57) G6PDUSP2MEN1KMT2AALOX12
SCHEMBL24111074 0.84 ALOX12 (0.45) USP2KMT2AALOX12
SCHEMBL24110985 0.83 G6PD (0.50) G6PDCYP19A1CYP1A2CYP3A4USP2
SCHEMBL23065106 0.82 SMN1; SMN2 (0.50) SMN1; SMN2CYP1A2CYP3A4USP2ALDH1A1
SCHEMBL24111000 0.82 ALOX12 (0.49) G6PDUSP2MEN1KMT2AALOX12
SCHEMBL23958196 0.82 ADORA2A (0.49) CYP19A1SMN1; SMN2CYP1A2CYP3A4USP2
SCHEMBL24110973 0.81 ALOX12 (0.47) G6PDUSP2MEN1KMT2AALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210387967-A1 2-HETEROARYL AMINOQUINAZOLINONE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2021-12-16 US disclosed
WO-2021215537-A1 2-HETEROARYLAMINOQUINAZOLINONE DERIVATIVE 大日本住友製薬株式会社 (JP) 2021-10-28 WO 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-20210387967-A1 2-HETEROARYL AMINOQUINAZOLINONE DERIVATIVE CRKL, CLIC4, CLIC1 G6PD 1971/4885CYP19A1 2573/4885SMN1; SMN2 3266/4885

“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.