SCHEMBL24252574

SCHEMBL24252574

c1ccc(-c2ccc3c(c2)c2cc(-c4nc(-c5cccnc5)cc(-c5cccc(-c6cccnc6)c5)n4)ccc2n3-c2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 3/20 0.47
▸ KMO O15229 1/20 0.44
▸ DHODH Q02127 1/20 0.44
▸ PGR P06401 1/20 0.41
▸ CYP11B1 P15538 3/20 0.41
▸ CYP11B2 P19099 3/20 0.41
▸ CYP17A1 P05093 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ MKNK1 Q9BUB5 2/20 0.40
▸ MKNK2 Q9HBH9 2/20 0.40
▸ GRM5 P41594 1/20 0.39
▸ NR4A2 P43354 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ PSD A5PKW4 2/20 0.38
▸ CDK7 P50613 1/20 0.38
▸ PIK3CA P42336 1/20 0.38

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
SCHEMBL24252239 0.95 DHODH (0.44) CYP19A1KMODHODHPGRCYP11B1
SCHEMBL17618162 0.90 MEN1 (0.38) CYP19A1DHODHMAPT
SCHEMBL17853604 0.90 CYP19A1 (0.47) CYP19A1KMODHODHCYP11B1CYP11B2
SCHEMBL17618124 0.89 DHODH (0.39) CYP19A1KMODHODHPGRCYP11B1
SCHEMBL17618156 0.89 MEN1 (0.40) CYP19A1DHODHMAPT
SCHEMBL17853514 0.89 DHODH (0.46) CYP19A1DHODHCYP11B1CYP11B2CYP17A1
SCHEMBL15783322 0.89 MAPT (0.43) CYP19A1KMODHODHPGRCYP11B1
SCHEMBL17853527 0.89 DHODH (0.46) CYP19A1DHODHCYP11B1CYP11B2CYP17A1
SCHEMBL19486661 0.88 DHODH (0.44) CYP19A1DHODHCYP11B1CYP11B2CYP17A1
SCHEMBL19486911 0.88 DHODH (0.44) CYP19A1DHODHCYP11B1CYP11B2CYP17A1

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-20220052268-A1 COMPOUND HAVING PYRIMIDINE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO., LTD. (JP) 2022-02-17 — — 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-20220052268-A1 COMPOUND HAVING PYRIMIDINE RING STRUCTURE AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC29A1, NUDT1, SLC29A2 CYP19A1 2810/4885KMO 3751/4885DHODH 202/4885

“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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