SCHEMBL30294667

SCHEMBL30294667

COc1ccc(NC(=O)c2cc(F)ccc2Nc2ccc(F)cc2C(C)C)c(C)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 2/20 0.41
▸ MRGPRX1 Q96LB2 4/20 0.40
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ TSPO P30536 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ P2RX7 Q99572 3/20 0.37
▸ NNMT P40261 1/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ RECQL P46063 1/20 0.36

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
SCHEMBL22853123 1.00 DHODH (0.41) DHODHMRGPRX1CYP1A2CYP3A4CYP2C19
SCHEMBL22853160 0.93 ALDH1A1 (0.45) DHODHMRGPRX1SMN1; SMN2ALDH1A1HPGD
SCHEMBL30294455 0.93 DHODH (0.42) DHODHCYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL22852858 0.93 DHODH (0.42) DHODHCYP1A2CYP3A4CYP2C19SMN1; SMN2
SCHEMBL22853162 0.93 DHODH (0.40) DHODHMRGPRX1SMN1; SMN2ALDH1A1HPGD
SCHEMBL30294834 0.93 DHODH (0.40) DHODHMRGPRX1SMN1; SMN2ALDH1A1HPGD
SCHEMBL30294780 0.92 SORT1 (0.43) DHODHHPGDKDM4E
SCHEMBL22853149 0.92 SORT1 (0.43) DHODHHPGDKDM4E
SCHEMBL22853113 0.90 DHODH (0.39) DHODHMRGPRX1SMN1; SMN2ALDH1A1HPGD
SCHEMBL30294668 0.90 DHODH (0.39) DHODHMRGPRX1SMN1; SMN2ALDH1A1HPGD

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-20230103791-A1 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-04-06 — — 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-20230103791-A1 2,3-DIHYDROQUINAZOLIN COMPOUNDS AS NAV1.8 INHIBITORS SCN8A, SCN1A, SCN1B DHODH 1951/4885MRGPRX1 566/4885CYP1A2 1465/4885

“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.

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