SCHEMBL4494576

SCHEMBL4494576

CN1CCN(Cc2ccc(NC(=C3C(=O)Nc4cc(F)ccc43)c3ccccc3)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 6/20 0.44
FAAH O00519 1/20 0.43
RET P07949 1/20 0.43
ACHE P22303 1/20 0.42
NPC1 O15118 2/20 0.41
TP53 P04637 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HDAC1 Q13547 1/20 0.41
TNKS O95271 1/20 0.40
DYRK1A Q13627 1/20 0.40
KDR P35968 1/20 0.40
FLT3 P36888 1/20 0.40
BTK Q06187 1/20 0.40
POLB P06746 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL4494567 1.00 NTRK1 (0.44) NTRK1FAAHRETACHENPC1
SCHEMBL4489205 0.92 RAB9A (0.45) FAAHNPC1TP53RAB9ASMN1; SMN2
SCHEMBL4489206 0.92 RAB9A (0.45) FAAHNPC1TP53RAB9ASMN1; SMN2
SCHEMBL4479654 0.91 RAB9A (0.46) FAAHACHENPC1TP53RAB9A
SCHEMBL4479647 0.91 RAB9A (0.46) FAAHACHENPC1TP53RAB9A
SCHEMBL4493647 0.90 PLK1 (0.46) NTRK1FAAHRETACHESMN1; SMN2
SCHEMBL4487341 0.90 FAAH (0.44) NTRK1FAAHRETACHENPC1
SCHEMBL4493644 0.90 PLK1 (0.46) NTRK1FAAHRETACHESMN1; SMN2
SCHEMBL4487333 0.90 FAAH (0.44) NTRK1FAAHRETACHENPC1
SCHEMBL4494104 0.90 SLC2A1 (0.45) FAAHNPC1TP53RAB9ASMN1; SMN2

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 NTRK1 76/4885FAAH 4521/4885RET 8/4885

“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.