SCHEMBL24623625

SCHEMBL24623625

c1cnc2sc3ccnnc3c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 6/20 0.45
LIMK1 P53667 4/20 0.45
CDC7 O00311 1/20 0.45
DBF4 Q9UBU7 1/20 0.45
IKBKB O14920 1/20 0.38
CHUK O15111 1/20 0.38
PIK3CA P42336 2/20 0.37
EGFR P00533 1/20 0.35
TLR5 O60602 1/20 0.34
NPC1 O15118 2/20 0.34
HSP90AA1 P07900 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 2/20 0.33
HPGD P15428 1/20 0.33
MAPT P10636 1/20 0.33
PRKCI P41743 2/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL11884995 0.81 LIMK1 (0.50) CLK1LIMK1CDC7DBF4IKBKB
SCHEMBL4886995 0.79 CLK1 (0.43) CLK1LIMK1CDC7DBF4IKBKB
SCHEMBL24623703 0.79 LIMK1 (0.39) CLK1LIMK1CDC7DBF4NPC1
SCHEMBL24624022 0.76
SCHEMBL24623724 0.76 LIMK1 (0.46) CLK1LIMK1NPC1HSP90AA1L3MBTL1
SCHEMBL16685185 0.76 GPR3 (0.50) LIMK1EGFRKDM4EHPGDMAPT
SCHEMBL24623977 0.76
SCHEMBL24623615 0.76 LIMK1 (0.41) CLK1LIMK1CDC7DBF4IKBKB
SCHEMBL24624030 0.75 CLK1 (0.49) CLK1LIMK1CDC7DBF4IKBKB
SCHEMBL22373808 0.72 LIMK1 (0.50) CLK1LIMK1CDC7DBF4IKBKB

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 CLK1 2296/4885LIMK1 3355/4885CDC7 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.