SCHEMBL900155

SCHEMBL900155

Cc1cc(N2CCN(C(=O)O)CC2)c2ccccc2n1

nearest known ligand 0.82

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 7/20 0.82
MEN1 O00255 4/20 0.73
KMT2A Q03164 4/20 0.73
ADRB2 P07550 1/20 0.64
ADRB1 P08588 1/20 0.64
HTT P42858 4/20 0.63
LMNA P02545 3/20 0.63
MAPK1 P28482 3/20 0.63
USP2 O75604 2/20 0.63
HSD17B10 Q99714 2/20 0.63
PKM P14618 1/20 0.63
MAPT P10636 2/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
NPSR1 Q6W5P4 2/20 0.57
TSHR P16473 1/20 0.57
KDM4E B2RXH2 1/20 0.56
RECQL P46063 1/20 0.56

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
SCHEMBL17276464 0.89 NCF1 (0.79) NCF1MEN1KMT2AADRB2ADRB1
SCHEMBL21392990 0.87 MEN1 (0.78) NCF1MEN1KMT2AADRB2ADRB1
SCHEMBL15277916 0.87 NCF1 (0.75) NCF1MEN1KMT2AADRB2ADRB1
SCHEMBL5523102 0.85 NCF1 (0.72) NCF1MEN1KMT2AADRB2ADRB1
SCHEMBL5065450 0.84 NCF1 (0.88) NCF1MEN1KMT2AADRB2ADRB1
SCHEMBL4178112 0.83 NCF1 (0.59) NCF1MEN1KMT2A
SCHEMBL6125246 0.82 NCF1 (0.75) NCF1MEN1KMT2AADRB2ADRB1
SCHEMBL30511704 0.82 NCF1 (0.97) NCF1MEN1KMT2AADRB2ADRB1
SCHEMBL15152938 0.82 MEN1 (0.78) NCF1MEN1KMT2AADRB2ADRB1
SCHEMBL5530017 0.82 NCF1 (0.67) NCF1MEN1KMT2AADRB2ADRB1

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
EP-2621923-B1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES INTERVET INT BV (NL) 2017-03-29 EP disclosed
EP-2828253-A1 CARBAMATE COMPOUNDS AND OF MAKING AND USING SAME Abide Therapeutics, Inc. (US) 2015-01-28 EP disclosed
US-8883791-B2 N-heteroaryl compounds with cyclic bridging unit for the treatment of parasitic diseases INTERVET INC. (US) 2014-11-11 US disclosed
WO-2013142307-A1 CARBAMATE COMPOUNDS AND OF MAKING AND USING SAME ABIDE THERAPEUTICS (US) 2013-09-26 WO disclosed
US-20130203768-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES INTERVET INC. 2013-08-08 US disclosed
EP-2621923-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES Intervet International B.V. (NL) 2013-08-07 EP disclosed
WO-2012041872-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES INTERVET INTERNATIONAL B.V. (NL) 2012-04-05 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-20130203768-A1 N-HETEROARYL COMPOUNDS WITH CYCLIC BRIDGING UNIT FOR THE TREATMENT OF PARASITIC DISEASES PIGO, HNMT, PIGS NCF1 823/4885MEN1 1483/4885KMT2A 2910/4885

“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.