SCHEMBL3933400

SCHEMBL3933400

CN(C)Cc1ccc(NC(=C2C(=O)Nc3ccccc32)c2ccc3nc[nH]c3c2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.45
NPC1 O15118 3/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
HTT P42858 2/20 0.40
NAMPT P43490 1/20 0.40
MAPK1 P28482 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
MAPT P10636 1/20 0.39
KHK P50053 2/20 0.38
CTNNB1 P35222 1/20 0.38
WNT3A P56704 1/20 0.38
SLC2A1 P11166 1/20 0.38
QPCT Q16769 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL3933394 0.93 SLC2A1 (0.40) RAB9ANPC1KMT2AMEN1POLB
SCHEMBL6323528 0.82 IDO1 (0.40) SMN1; SMN2MAPTALDH1A1
SCHEMBL30979384 0.82 IDO1 (0.40) SMN1; SMN2MAPTALDH1A1
SCHEMBL6323531 0.82 IDO1 (0.40) SMN1; SMN2MAPTALDH1A1
SCHEMBL6326854 0.81 MAPT (0.41) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL6326859 0.81 MAPT (0.41) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL3943289 0.81 SLC2A1 (0.42) RAB9ANPC1KMT2APOLBSMN1; SMN2
SCHEMBL3943293 0.81 SLC2A1 (0.42) RAB9ANPC1KMT2APOLBSMN1; SMN2
SCHEMBL6322253 0.81 KMT2A (0.40) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL6322247 0.81 KMT2A (0.40) RAB9ANPC1KMT2AMEN1SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1551830-B1 HETEROCYCLICALLY SUBSTITUTED INDOLINONES AND THEIR USE AS RECEPTOR TYROSINE KINASE INHIBATORS BOEHRINGER INGELHEIM PHARMA (DE) 2009-04-08 EP disclosed
US-7148249-B2 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2006-12-12 US disclosed
EP-1551830-A2 HETEROCYCLICALLY SUBSTITUTED INDOLINONES AND THEIR USE AS RECEPTOR TYROSINE KINASE INHIBATORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-07-13 EP disclosed
US-20050054710-A1 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-03-10 US disclosed
WO-2004026829-A2 HETEROCYCLICALLY SUBSTITUTED INDOLINONES AND THEIR USE AS RECEPTOR TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-04-01 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-20050054710-A1 Indolinones substituted by heterocycles, the preparation thereof and their use as medicaments CDK1, CDK2, CDK3 RAB9A 3709/4885NPC1 4723/4885KMT2A 1839/4885

“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.