SCHEMBL24252238

SCHEMBL24252238

c1cncc(-c2ccc(-c3cc(-c4ccc(-c5ccncc5)cc4)nc(-c4ccc(-c5ccc6ccccc6c5)cc4)n3)cc2)c1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 8/20 0.69
CYP11B1 P15538 7/20 0.69
CYP19A1 P11511 6/20 0.69
CYP17A1 P05093 4/20 0.69
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
CYP2A6 P11509 1/20 0.49
CYP1A1 P04798 1/20 0.47
CYP1B1 Q16678 1/20 0.47
SIRT2 Q8IXJ6 1/20 0.46
CYP3A4 P08684 1/20 0.46
DHODH Q02127 1/20 0.45
MAPK9 P45984 3/20 0.44
MAPK10 P53779 3/20 0.44
MAPK8 P45983 2/20 0.44
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44

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
SCHEMBL24252566 0.96 CYP11B2 (0.67) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL17808172 0.94 CYP11B2 (0.73) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL19397379 0.94 CYP11B2 (0.73) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL23095117 0.94 CYP11B2 (0.73) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL17808057 0.94 CYP11B2 (0.73) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL17808063 0.92 CYP11B2 (0.69) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL21725381 0.92 CYP11B2 (0.69) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL17945800 0.91 CYP11B2 (0.73) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL21841074 0.91 CYP11B2 (0.73) CYP11B2CYP11B1CYP19A1CYP17A1NPC1
SCHEMBL17343464 0.90 CYP11B2 (0.63) CYP11B2CYP11B1CYP19A1CYP17A1NPC1

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 CYP11B2 3916/4885CYP11B1 4052/4885CYP19A1 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.