SCHEMBL3703713

SCHEMBL3703713

O=C(O)c1ccc(NC(=O)N2Cc3ccccc3C2)cc1

nearest known ligand 0.77

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 17/20 0.77
TAS1R3 Q7RTX0 3/20 0.69
TAS1R1 Q7RTX1 3/20 0.69
TAS1R2 Q8TE23 3/20 0.69
NPC1 O15118 1/20 0.63
TP53 P04637 1/20 0.63
RAB9A P51151 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63

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
SCHEMBL3707375 0.90 RAB9A (0.81) NAMPTTAS1R3TAS1R1TAS1R2NPC1
SCHEMBL10226370 0.88 NPC1 (0.78) NAMPTTAS1R3TAS1R1TAS1R2NPC1
SCHEMBL3704115 0.88 NAMPT (0.78) NAMPT
SCHEMBL3709164 0.87 NAMPT (1.00) NAMPTTAS1R3TAS1R1TAS1R2
SCHEMBL3698520 0.86 NAMPT (0.75) NAMPTTAS1R3TAS1R1TAS1R2
SCHEMBL3703827 0.85 NAMPT (1.00) NAMPT
SCHEMBL3697328 0.83 NAMPT (1.00) NAMPTTAS1R3TAS1R1TAS1R2
SCHEMBL3701200 0.83 NAMPT (0.71) NAMPTTAS1R3TAS1R1TAS1R2
SCHEMBL24947713 0.83 NAMPT (0.67) NAMPTNPC1RAB9A
SCHEMBL3698598 0.83 NAMPT (0.73) NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10093624-B2 NAMPT and ROCK inhibitors ABBVIE INC. (US) 2018-10-09 US disclosed
EP-2776393-B1 NAMPT INHIBITORS ABBVIE INC (US) 2017-12-20 EP disclosed
US-20170253562-A1 Nampt Inhibitors ABBVIE INC (US) 2017-09-07 US disclosed
CN-104039762-B Nampt inhibitor ABBVIE INC. (US) 2016-11-30 CN disclosed
US-9302989-B2 NAMPT and rock inhibitors ABBVIE INC. (US) 2016-04-05 US disclosed
US-20160031813-A1 Nampt Inhibitors ABBVIE INC. 2016-02-04 US disclosed
US-20160031880-A1 Nampt and Rock Inhibitors ABBVIE INC. (US) 2016-02-04 US disclosed
EP-2776393-A1 NAMPT INHIBITORS Abbvie Inc. (US) 2014-09-17 EP disclosed
EP-2640698-A1 NAMPT AND ROCK INHIBITORS AbbVie Inc. (US) 2013-09-25 EP disclosed
WO-2013067710-A1 NAMPT INHIBITORS ABBOTT LABORATORIES (US) 2013-05-16 WO disclosed
WO-2012067965-A1 NAMPT AND ROCK INHIBITORS ABBOTT LABORATORIES (US) 2012-05-24 WO disclosed
US-20120122842-A1 NAMPT AND ROCK INHIBITORS ABBOTT LABORATORIES (US) 2012-05-17 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 (5 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-10093624-B2 NAMPT and ROCK inhibitors NAMPT, NNMT, NADK NAMPT 1/4885TAS1R3 3988/4885TAS1R1 4181/4885
US-20120122842-A1 NAMPT AND ROCK INHIBITORS NAMPT, NNMT, NME2 NAMPT 1/4885TAS1R3 4597/4885TAS1R1 4638/4885
US-20170253562-A1 Nampt Inhibitors NAMPT, NNMT, NAPRT NAMPT 1/4885TAS1R3 4117/4885TAS1R1 4081/4885
US-20160031813-A1 Nampt Inhibitors NAMPT, NNMT, NAPRT NAMPT 1/4885TAS1R3 4117/4885TAS1R1 4081/4885
US-20160031880-A1 Nampt and Rock Inhibitors NAMPT, NNMT, NME2 NAMPT 1/4885TAS1R3 4597/4885TAS1R1 4638/4885

“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.