SCHEMBL24252581

SCHEMBL24252581

c1cncc(-c2cccc(-c3cc(-c4cccnc4)nc(-c4ccc(-c5cc6ccccc6c6ccccc56)cc4)n3)c2)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 8/20 0.63
CYP11B2 P19099 7/20 0.48
CYP19A1 P11511 2/20 0.48
CYP17A1 P05093 1/20 0.48
KMO O15229 1/20 0.45
DHODH Q02127 1/20 0.44
GPR84 Q9NQS5 1/20 0.44
CYP2A6 P11509 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PGR P06401 1/20 0.41
HIPK2 Q9H2X6 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.40
CYP2C9 P11712 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
SCHEMBL17918139 0.96 CYP11B1 (0.62) CYP11B1CYP11B2CYP19A1CYP17A1KMO
SCHEMBL24252590 0.96 CYP11B1 (0.62) CYP11B1CYP11B2CYP19A1CYP17A1KMO
SCHEMBL17808016 0.96 CYP11B1 (0.62) CYP11B1CYP11B2CYP19A1CYP17A1KMO
SCHEMBL17808141 0.95 CYP11B1 (0.60) CYP11B1CYP11B2CYP19A1CYP17A1KMO
SCHEMBL17808077 0.94 CYP11B1 (0.62) CYP11B1CYP11B2CYP19A1CYP17A1KMO
SCHEMBL17808039 0.94 CYP11B1 (0.65) CYP11B1CYP11B2CYP19A1CYP17A1KMO
SCHEMBL17808043 0.93 CYP11B1 (0.63) CYP11B1CYP11B2CYP19A1CYP17A1KMO
SCHEMBL19166435 0.92 CYP11B1 (0.56) CYP11B1CYP11B2CYP19A1CYP17A1KMO
SCHEMBL19168344 0.92 CYP11B1 (0.56) CYP11B1CYP11B2CYP19A1CYP17A1KMO
SCHEMBL17808170 0.92 CYP11B1 (0.56) CYP11B1CYP11B2CYP19A1CYP17A1DHODH

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 CYP11B1 4052/4885CYP11B2 3916/4885CYP19A1 2810/4885

“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.