SCHEMBL14813680

SCHEMBL14813680

c1ccc(CCN[C@@H]2CCCNC2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.57
GRIN2B Q13224 7/20 0.54
KDM1A O60341 1/20 0.48
MAOB P27338 1/20 0.48
SIGMAR1 Q99720 3/20 0.46
OPRM1 P35372 1/20 0.45
OPRL1 P41146 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 1/20 0.44
ALOX12 P18054 1/20 0.44
TP53 P04637 1/20 0.44
EPHX1 P07099 1/20 0.44
TSHR P16473 1/20 0.44
EPHX2 P34913 1/20 0.44
GRIN1 Q05586 1/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43

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
SCHEMBL10496394 1.00 TAAR1 (0.57) TAAR1GRIN2BKDM1AMAOBSIGMAR1
SCHEMBL28215970 0.90 GRIN2B (0.57) TAAR1GRIN2BKDM1AMAOBSIGMAR1
SCHEMBL30638147 0.90 GRIN2B (0.57) TAAR1GRIN2BKDM1AMAOBSIGMAR1
SCHEMBL28094036 0.85 KDM1A (0.43) TAAR1GRIN2BKDM1A
SCHEMBL2687312 0.84 SLC6A2 (0.52) GRIN2BKDM1AMAOBOPRM1OPRL1
SCHEMBL994345 0.84 SLC6A2 (0.52) GRIN2BKDM1AMAOBOPRM1OPRL1
Hydrochloric Acid SCHEMBL28038612 0.84 KDM1A (0.42) TAAR1GRIN2BKDM1AOPRM1OPRL1
Hydrochloric Acid SCHEMBL28698584 0.84 KDM1A (0.42) TAAR1GRIN2BKDM1AOPRM1OPRL1
SCHEMBL3760581 0.81 TAAR1 (0.75) TAAR1GRIN2BSIGMAR1OPRM1OPRL1
SCHEMBL3907332 0.81 TAAR1 (0.81) TAAR1GRIN2BSIGMAR1OPRM1OPRL1

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
EP-2760862-B1 6-(4-HYDROXY-PHENYL)-3-ALKYL-1H-PYRAZOLO[3,4-B]PYRIDINE-4-CARBOXYLIC ACID AMIDE DERIVATIVES AS KINASE INHIBITORS SANOFI SA (FR) 2015-10-21 EP claimed
US-20130085128-A1 6-(4-Hydroxy-phenyl)-3-alkyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid amide derivatives as kinase inhibitors SANOFI (FR) 2013-04-04 US claimed

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-20130085128-A1 6-(4-Hydroxy-phenyl)-3-alkyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid amide derivatives as kinase inhibitors MAP3K1, MAP3K6, MAP4K2 TAAR1 1909/4885GRIN2B 1300/4885KDM1A 1636/4885

“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.