SCHEMBL24624005

SCHEMBL24624005

c1cc2c(cn1)sc1ncnnc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HTT P42858 2/20 0.34
NCOA1 Q15788 2/20 0.34
NCOA3 Q9Y6Q9 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
RCE1 Q9Y256 1/20 0.34
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
CLK1 P49759 2/20 0.31
CDK5 Q00535 1/20 0.31
CDK5R1 Q15078 1/20 0.31
CYP2A6 P11509 2/20 0.30

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
SCHEMBL24624004 0.88 PIK3CD (0.33) PIK3CDPIK3CAPIK3CBPIK3CGCLK1
SCHEMBL24623999 0.86 KDM4E (0.34) KDM4EALDH1A1HTTNCOA1NCOA3
SCHEMBL24623813 0.81
SCHEMBL24623619 0.80 KDM4E (0.36) KDM4EALDH1A1HTTNCOA1NCOA3
SCHEMBL24623614 0.79 LIMK1 (0.45) ALDH1A1HPGDPIK3CACDK5CDK5R1
SCHEMBL24623627 0.75 KDM4E (0.36) KDM4EALDH1A1HTTNCOA1NCOA3
SCHEMBL24270400 0.75 KDM4E (0.36) KDM4EALDH1A1HTTNCOA1NCOA3
SCHEMBL24623622 0.73 KDM4E (0.36) KDM4EALDH1A1HTTNCOA1NCOA3
SCHEMBL24623988 0.73
SCHEMBL22483133 0.73 KDM4E (0.36) KDM4EALDH1A1HTTNCOA1NCOA3

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-20220223794-A1 HETEROCYCLIC COMPOUND CONTAINING HETEROATOM SUBSTITUTED FLUORENE AND APPLICATION THEREOF Wuhan Tianma Microelectronics Co., Ltd. Shanghai Branch (CN) 2022-07-14 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-20220223794-A1 HETEROCYCLIC COMPOUND CONTAINING HETEROATOM SUBSTITUTED FLUORENE AND APPLICATION THEREOF NR0B2, FPR3, NPR3 KDM4E 3659/4885ALDH1A1 4623/4885HTT 3470/4885

“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.