SCHEMBL899212

SCHEMBL899212

Cc1cc(NCCN)cc(Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
NPY1R P25929 1/20 0.36
SYK P43405 1/20 0.35
KARS1 Q15046 1/20 0.35
SUV39H2 Q9H5I1 2/20 0.34
SOS1 Q07889 1/20 0.34
CHEK1 O14757 1/20 0.34
CAMK2D Q13557 2/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
CDC7 O00311 1/20 0.33
DAPK3 O43293 1/20 0.33
ROCK2 O75116 1/20 0.33

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
SCHEMBL19462560 0.72 NOS3 (0.40) SMN1; SMN2MEN1MAPK1KMT2AADORA2A
SCHEMBL30329688 0.72 NOS3 (0.40) SMN1; SMN2MEN1MAPK1KMT2AADORA2A
SCHEMBL10483989 0.72 MC4R (0.42) SMN1; SMN2MEN1KMT2A
SCHEMBL9884955 0.71 SMN1; SMN2 (0.49) STK17ASMN1; SMN2NPY1RSYKCAMK2D
SCHEMBL27929805 0.69 ALDH1A1 (0.43) KARS1MEN1GAAKMT2A
SCHEMBL19030966 0.69 LOX (0.48) STK17AKARS1CAMK2DCYP2D6
SCHEMBL29714427 0.67 LOX (0.45) SMN1; SMN2MEN1MAPK1KMT2AADORA2A
SCHEMBL19755849 0.67 LOX (0.45) SMN1; SMN2MEN1MAPK1KMT2AADORA2A
SCHEMBL10847759 0.67 CYP3A4 (0.42) STK17ASUV39H2CAMK2DMEN1KMT2A
SCHEMBL10483887 0.67 MC4R (0.45) SMN1; SMN2MEN1KMT2A

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-20200283389-A1 IMPROVED PROCESS FOR MAKING CROTONYLAMINOPYRIDINIES INTERVET INC. (US) 2020-09-10 US disclosed
WO-2017109027-A1 IMPROVED PROCESS FOR MAKING CROTONYLAMINOPYRIDINES INTERVET INTERNATIONAL B.V. (NL) 2017-06-29 WO disclosed
EP-2621903-B1 N-HETEROARYL COMPOUNDS INTERVET INT BV (NL) 2017-03-01 EP disclosed
US-8877934-B2 N-heteroaryl compounds INTERVET INC. (US) 2014-11-04 US disclosed
EP-2621903-A1 N-HETEROARYL COMPOUNDS Intervet International B.V. (NL) 2013-08-07 EP disclosed
US-20130196993-A1 N-HETEROARYL COMPOUNDS INTERVET INC. 2013-08-01 US disclosed
WO-2012041873-A1 N-HETEROARYL COMPOUNDS 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 (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-20130196993-A1 N-HETEROARYL COMPOUNDS HNMT, SQLE, PIGO STK17A 3855/4885SMN1; SMN2 4016/4885NPY1R 3888/4885
US-20200283389-A1 IMPROVED PROCESS FOR MAKING CROTONYLAMINOPYRIDINIES CROCC, DHPS, NPEPPS STK17A 1878/4885SMN1; SMN2 768/4885NPY1R 4068/4885

“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.