SCHEMBL24623997

SCHEMBL24623997

c1cnc2sc3nncnc3c2c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 6/20 0.53
LIMK1 P53667 3/20 0.53
CDC7 O00311 1/20 0.53
DBF4 Q9UBU7 1/20 0.53
PIK3CA P42336 2/20 0.43
TLR5 O60602 3/20 0.42
EGFR P00533 1/20 0.40
IKBKB O14920 1/20 0.38
CHUK O15111 1/20 0.38
NPC1 O15118 2/20 0.34
HSP90AA1 P07900 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
PRKCI P41743 2/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 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
SCHEMBL24624030 0.86 CLK1 (0.49) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL24623623 0.79 LIMK1 (0.51) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL24623626 0.76 LIMK1 (0.49) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL4903332 0.76 LIMK1 (0.50) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL24623615 0.76 LIMK1 (0.41) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL24624003 0.75 LIMK1 (0.50) CLK1LIMK1CDC7DBF4NPC1
SCHEMBL24623625 0.71 CLK1 (0.45) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL24623999 0.70 KDM4E (0.34) CLK1LIMK1HPGDKDM4ELMNA
SCHEMBL2855389 0.70 CLK1 (0.51) CLK1LIMK1CDC7DBF4PIK3CA
SCHEMBL11884995 0.69 LIMK1 (0.50) CLK1LIMK1CDC7DBF4PIK3CA

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.