SCHEMBL15044979

SCHEMBL15044979

Cc1ccccc1-c1cnc(C(C)(C)C)cn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.43
METAP2 P50579 1/20 0.43
ALOX5AP P20292 3/20 0.41
FEN1 P39748 3/20 0.41
CYP1A2 P05177 7/20 0.39
CYP2D6 P10635 6/20 0.39
CYP2C19 P33261 5/20 0.39
CYP3A4 P08684 4/20 0.39
ALDH1A1 P00352 3/20 0.39
CLK4 Q9HAZ1 3/20 0.39
HSD17B10 Q99714 2/20 0.39
ALOX15 P16050 1/20 0.39
OXTR P30559 3/20 0.38
AVPR1A P37288 2/20 0.38
TSHR P16473 2/20 0.36
MAPK1 P28482 2/20 0.36
SDHB P21912 1/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 3/20 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
SCHEMBL3424160 0.84 IDO1 (0.55) IDO1METAP2ALOX5APFEN1CYP1A2
SCHEMBL12186161 0.77 CYP1A2 (0.49) IDO1METAP2ALOX5APFEN1CYP1A2
SCHEMBL16622251 0.76 NPC1 (0.49) IDO1METAP2ALOX5APFEN1CYP1A2
SCHEMBL10220157 0.76 MEN1 (0.42) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL18571289 0.75 IDO1 (0.43) IDO1METAP2ALOX5APFEN1CYP1A2
SCHEMBL17808206 0.75 CYP1A2 (0.39) IDO1METAP2CYP1A2CYP2D6CYP2C19
SCHEMBL28107573 0.74 FEN1 (0.66) ALOX5APFEN1
SCHEMBL23255785 0.74 CYP1A2 (0.45) IDO1METAP2ALOX5APFEN1CYP1A2
SCHEMBL26165300 0.74 CYP1A2 (0.45) IDO1METAP2ALOX5APFEN1CYP1A2
SCHEMBL8227859 0.73 CCR1 (0.60) IDO1METAP2ALOX5APFEN1CYP1A2

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-8754226-B2 Piperidinyl-substituted lactams as GPR119 modulators ARRAY BIOPHARMA INC. (US) 2014-06-17 US disclosed
US-20130158009-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA, INC. 2013-06-20 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-20130158009-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS GPR119, GPR139, GPR39 IDO1 3366/4885METAP2 2311/4885ALOX5AP 2439/4885

“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.