SCHEMBL24252707

SCHEMBL24252707

c1cncc(-c2cc(-c3ccc(-c4ccc(-c5ccncc5)cc4)cc3)nc(-c3ccc(-c4cc5ccccc5c5ccccc45)c4ccccc34)n2)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 9/20 0.58
CYP19A1 P11511 3/20 0.47
DHODH Q02127 2/20 0.46
GPR84 Q9NQS5 1/20 0.44
CYP11B2 P19099 8/20 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
CYP17A1 P05093 1/20 0.40
HIPK2 Q9H2X6 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP3A4 P08684 1/20 0.39
PIK3CA P42336 1/20 0.39

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
SCHEMBL24252784 0.91 CYP11B1 (0.62) CYP11B1CYP19A1DHODHGPR84CYP11B2
SCHEMBL19638272 0.86 CYP11B1 (0.66) CYP11B1CYP19A1DHODHGPR84CYP11B2
SCHEMBL21725403 0.86 CYP11B1 (0.66) CYP11B1CYP19A1DHODHGPR84CYP11B2
SCHEMBL19638082 0.85 CYP11B1 (0.64) CYP11B1CYP19A1DHODHGPR84CYP11B2
SCHEMBL24252568 0.85 DHODH (0.53) CYP11B1CYP19A1DHODHCYP11B2KDM4E
SCHEMBL22227765 0.84 CYP11B1 (0.67) CYP11B1CYP19A1DHODHGPR84CYP11B2
SCHEMBL24252242 0.82 CYP11B1 (0.68) CYP11B1CYP19A1DHODHGPR84CYP11B2
SCHEMBL17918052 0.82 CYP11B1 (0.68) CYP11B1CYP19A1DHODHGPR84CYP11B2
SCHEMBL24252593 0.82 CYP11B1 (0.68) CYP11B1CYP19A1DHODHGPR84CYP11B2
SCHEMBL30857455 0.82 CYP11B1 (0.68) CYP11B1CYP19A1DHODHGPR84CYP11B2

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 4052/4885CYP19A1 2810/4885DHODH 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.