SCHEMBL3581648

SCHEMBL3581648

Cc1ccccc1C(=O)Nc1cccc(C(=O)c2ccc3c(c2)NC(=O)C3)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 3/20 0.54
KCNK9 Q9NPC2 3/20 0.54
RAB9A P51151 2/20 0.51
POLB P06746 2/20 0.51
PKM P14618 1/20 0.51
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
TP53 P04637 1/20 0.49
THRB P10828 1/20 0.49
ALDH1A1 P00352 2/20 0.48
CRBN Q96SW2 2/20 0.47
F2R P25116 1/20 0.47
GRM5 P41594 1/20 0.47
HPGD P15428 1/20 0.46
MAPT P10636 1/20 0.46
HTT P42858 1/20 0.46
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL3572611 0.83 CRBN (0.51) RAB9APOLBPKMALDH1A1CRBN
SCHEMBL396708 0.80 KCNK3 (0.57) KCNK3KCNK9POLBKMT2AMEN1
SCHEMBL23143565 0.77 TRPV1 (0.56) RAB9APKMSMN1; SMN2CRBN
SCHEMBL3579599 0.77 KMT2A (0.53) KCNK3KCNK9RAB9APOLBPKM
SCHEMBL3579596 0.77 KMT2A (0.53) KCNK3KCNK9RAB9APOLBPKM
SCHEMBL7679044 0.77 SMYD3 (0.53) ALDH1A1CRBN
SCHEMBL13256073 0.76 CRBN (0.47) CRBN
SCHEMBL3581850 0.75 CRBN (0.45) CRBN
SCHEMBL395950 0.75 TRPV1 (0.59) KCNK3KCNK9RAB9ASMN1; SMN2TP53
SCHEMBL3574898 0.74 SMYD3 (0.49) POLBCRBN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7749530-B2 Kinase inhibitors ALLERGAN, INC. (US) 2010-07-06 US disclosed
WO-2010075197-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2010-07-01 WO disclosed
US-7692005-B2 Kinase inhibitors ALLERGAN, INC. (US) 2010-04-06 US disclosed
US-20090208557-A1 Kinase inhibitors ALLERGAN, INC. 2009-08-20 US disclosed
EP-1902025-A1 KINASE INHIBITORS Allergan, Inc. (US) 2008-03-26 EP disclosed
US-20070032478-A1 Kinase Inhibitors ALLERGAN, INC. 2007-02-08 US disclosed
WO-2007008895-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2007-01-18 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 (2 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-20090208557-A1 Kinase inhibitors PTK2, MAP3K6, MAP3K20 KCNK3 1769/4885KCNK9 2468/4885RAB9A 2105/4885
US-20070032478-A1 Kinase Inhibitors ABL1, LCK, ERBB2 KCNK3 2162/4885KCNK9 3358/4885RAB9A 2799/4885

“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.