SCHEMBL10061665

SCHEMBL10061665

C=C1C(=O)Nc2ccc(C(=O)NC)cc21

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FCER2 P06734 1/20 0.44
SYK P43405 1/20 0.44
SMYD3 Q9H7B4 2/20 0.43
CRBN Q96SW2 2/20 0.42
MAPK14 Q16539 1/20 0.41
PDK2 Q15119 2/20 0.41
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HDAC2 Q92769 1/20 0.40
TLK2 Q86UE8 1/20 0.39
PLAU P00749 1/20 0.39
PDPK1 O15530 1/20 0.38
CCNC P24863 1/20 0.38
CDK8 P49336 1/20 0.38
OTUD7B Q6GQQ9 1/20 0.38
IP6K1 Q92551 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
SCHEMBL13712805 0.84 SMYD3 (0.45) SMYD3MAPK14PDK2
SCHEMBL10061664 0.82 PDPK1 (0.55) CRBNPDK2PDPK1
SCHEMBL10061663 0.81 TLK2 (0.51) FCER2SYKSMYD3TLK2PDPK1
SCHEMBL14446978 0.80 PAK4 (0.58) SMYD3
SCHEMBL13712799 0.79 FCER2 (0.53) FCER2SYKTLK2PDPK1
SCHEMBL11349200 0.76 KMT2A (0.55) PDK2HDAC8HDAC6HDAC2
SCHEMBL7233945 0.72 TP53 (0.43) FCER2SYKPDK2PDPK1
SCHEMBL7233951 0.72 TP53 (0.43) FCER2SYKPDK2PDPK1
SCHEMBL10061666 0.72 ROS1 (0.61) PDPK1
SCHEMBL31107477 0.72 ROS1 (0.61) PDPK1

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-8207179-B2 Substituted indolines as tyrosine kinase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-26 US disclosed
US-20100222331-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-09-02 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-20100222331-A1 NEW COMPOUNDS CCNA1, CCNY, MKI67 FCER2 4066/4885SYK 2888/4885SMYD3 2913/4885

“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.