SCHEMBL4484795

SCHEMBL4484795

CN1CCN(C(=O)Cc2ccc(N/C(=C3\C(=O)Nc4cc(F)ccc43)c3ccccc3)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 1/20 0.44
EPHX2 P34913 1/20 0.40
BACE1 P56817 1/20 0.39
MLNR O43193 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
NAMPT P43490 2/20 0.38
GAA P10253 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KMT2A Q03164 1/20 0.36
POLB P06746 1/20 0.36
BRD4 O60885 1/20 0.36
KDM1A O60341 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
RET P07949 1/20 0.36
JAK1 P23458 1/20 0.36

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
SCHEMBL4484798 1.00 TYK2 (0.44) TYK2EPHX2BACE1MLNRCYP3A4
SCHEMBL4487772 0.90 PIM1 (0.43) TYK2MAPTNAMPTGAANPC1
SCHEMBL4487775 0.90 PIM1 (0.43) TYK2MAPTNAMPTGAANPC1
SCHEMBL4501778 0.89 EPHX2 (0.53) EPHX2BACE1CYP3A4NAMPTPOLB
SCHEMBL4501781 0.89 EPHX2 (0.53) EPHX2BACE1CYP3A4NAMPTPOLB
SCHEMBL226897 0.88 EPHX2 (0.49) EPHX2BACE1NAMPTSMN1; SMN2KMT2A
SCHEMBL226898 0.88 EPHX2 (0.49) EPHX2BACE1NAMPTSMN1; SMN2KMT2A
SCHEMBL4484861 0.88 TYK2 (0.40) TYK2MLNRCYP3A4MAPTNAMPT
SCHEMBL4484864 0.88 TYK2 (0.40) TYK2MLNRCYP3A4MAPTNAMPT
SCHEMBL4494576 0.87 NTRK1 (0.44) MAPTNPC1RAB9ASMN1; SMN2POLB

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 4 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
EP-1527046-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-05-04 EP disclosed
WO-2004009546-A1 INDOLINE DERIVATIVES SUBSTITUTED IN POSITION 6, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-01-29 WO 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 TYK2 64/4885EPHX2 2278/4885BACE1 1615/4885

“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.