SCHEMBL18645882

SCHEMBL18645882

Brc1ccc2c(c1)[nH]c1c2ccc2sc3ccccc3c21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 4/20 0.46
CCND1 P24385 4/20 0.46
CCNB2 O95067 2/20 0.46
CCNE2 O96020 2/20 0.46
CDK1 P06493 2/20 0.46
CCNB1 P14635 2/20 0.46
CCNE1 P24864 2/20 0.46
CDK2 P24941 2/20 0.46
CCNB3 Q8WWL7 2/20 0.46
CAMK2B Q13554 2/20 0.46
CAMK2G Q13555 2/20 0.46
CAMK2D Q13557 2/20 0.46
CAMK2A Q9UQM7 2/20 0.46
CCNT1 O60563 1/20 0.46
EIF2AK2 P19525 1/20 0.46
CCNA2 P20248 1/20 0.46
CDK9 P50750 1/20 0.46
CDK5 Q00535 1/20 0.46
CDK5R1 Q15078 1/20 0.46
AR P10275 1/20 0.42

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
SCHEMBL31005005 1.00 CDK4 (0.46) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL783085 0.85 GABRP (0.56) CDK4CCND1CDK5CDK5R1PIM3
SCHEMBL29986173 0.85 GABRP (0.56) CDK4CCND1CDK5CDK5R1PIM3
Biphenyl SCHEMBL28985247 0.81 GABRP (0.51) CDK4CCND1CDK5CDK5R1GABRP
SCHEMBL21328048 0.80 KDM4E (0.60) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL15127062 0.80 KIF11 (0.56) CDK4CCND1CDK1CDK2CAMK2B
SCHEMBL15127081 0.79 HTR2B (0.45) CDK4CCND1CCNB2CCNE2CDK1
SCHEMBL25679616 0.78 GABRP (0.49) CDK4CCND1CDK5CDK5R1GABRP
SCHEMBL23098938 0.78 CDK9 (0.42) CDK4CCND1CCNE2CCNE1CDK2
SCHEMBL16276646 0.78 CDK4 (0.46) CDK4CCND1CCNB2CCNE2CDK1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12037348-B2 Blue and narrow band green and red emitting metal complexes ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2024-07-16 US disclosed
US-12037348-B2 Blue and narrow band green and red emitting metal complexes ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2024-07-16 US disclosed
WO-2017043835-A1 ORGANIC ELECTRONIC DIODE COMPOUND, ORGANIC ELECTRONIC DIODE USING SAME, AND DEVICE THEREFOR 덕산네오룩스 주식회사 2017-03-16 WO 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-12037348-B2 Blue and narrow band green and red emitting metal complexes OCIAD2, OCIAD1, ORC3 CDK4 799/4885CCND1 452/4885CCNB2 625/4885

“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.