SCHEMBL24623979

SCHEMBL24623979

c1nnc2c(n1)sc1ncnnc12

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
CDC7 O00311 1/20 0.30
PLK4 O00444 1/20 0.30
AURKA O14965 1/20 0.30
DAPK3 O43293 1/20 0.30
DYRK3 O43781 1/20 0.30
ROCK2 O75116 1/20 0.30
PRKD3 O94806 1/20 0.30
MAP4K4 O95819 1/20 0.30
CHEK2 O96017 1/20 0.30
PRKCG P05129 1/20 0.30
CDK1 P06493 1/20 0.30
RET P07949 1/20 0.30
ROS1 P08922 1/20 0.30
PIM1 P11309 1/20 0.30
PHKG2 P15735 1/20 0.30
PRKACA P17612 1/20 0.30
RPS6KB1 P23443 1/20 0.30
CDK2 P24941 1/20 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
SCHEMBL24623988 0.79
SCHEMBL24624030 0.76 CLK1 (0.49) ALDH1A1MAPTCDC7LIMK1
SCHEMBL24624001 0.76 LIMK1 (0.46) MAPTCDC7LIMK1
SCHEMBL24623614 0.73 LIMK1 (0.45) ALDH1A1MAPTLIMK1CDK5
SCHEMBL24624005 0.70 KDM4E (0.34) ALDH1A1LIMK1CDK5DYRK1A
SCHEMBL24624004 0.69 PIK3CD (0.33) DYRK1A
SCHEMBL23486238 0.69 ALDH1A1 (0.32) ALDH1A1MAPT
SCHEMBL24623986 0.61 ALDH1A1 (0.32) ALDH1A1MAPT
SCHEMBL24624032 0.61 ALDH1A1 (0.30) ALDH1A1
SCHEMBL25095793 0.58 CYP1A2 (0.34) ALDH1A1MAPT

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 ALDH1A1 4623/4885MAPT 4875/4885CDC7 1709/4885

“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.