SCHEMBL4487987

SCHEMBL4487987

CC(=O)N(CCCN(C)C)c1ccc(N/C(=C2\C(=O)Nc3cc(Cl)ccc32)c2ccc(N3CCCC3=O)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
F10 P00742 6/20 0.39
TSHR P16473 2/20 0.37
LMNA P02545 2/20 0.37
ATM Q13315 1/20 0.37
HPGD P15428 1/20 0.37
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
F2 P00734 1/20 0.37
CYP1A2 P05177 1/20 0.36
NPC1 O15118 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL4487990 1.00 F10 (0.39) F10TSHRLMNAATMHPGD
SCHEMBL4503967 0.88 KDM1A (0.34) F10MAPT
SCHEMBL4503962 0.88 KDM1A (0.34) F10MAPT
SCHEMBL225449 0.88 LRRK2 (0.36) F10MAPTF2NPC1
SCHEMBL225448 0.88 LRRK2 (0.36) F10MAPTF2NPC1
SCHEMBL4488448 0.86 LRRK2 (0.35) F10F2NPC1
SCHEMBL4488452 0.86 LRRK2 (0.35) F10F2NPC1
SCHEMBL4489404 0.85 F10 (0.40) F10TSHRLMNAATMHPGD
SCHEMBL4489405 0.85 F10 (0.40) F10TSHRLMNAATMHPGD
SCHEMBL4485494 0.85 KDM4E (0.37) ALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514468-B2 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2009-04-07 US disclosed
US-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-08-31 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-20060194813-A1 Indolinone derivatives substituted in the 6 position, the preparation thereof and their use as pharmaceutical compositions KDR, FLT1, EGFR F10 2068/4885TSHR 503/4885LMNA 1884/4885

“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.