SCHEMBL31560

SCHEMBL31560

Cc1cccc(-c2c(C)nc3ccc(C(=O)N4CCCCC4)cn23)c1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F2RL1 P55085 1/20 0.63
HPGD P15428 11/20 0.53
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 2/20 0.47
GLA P06280 1/20 0.47
KMT2A Q03164 2/20 0.43
DPP4 P27487 1/20 0.43
MEN1 O00255 1/20 0.43
GBA1 P04062 1/20 0.43
GRM5 P41594 2/20 0.42
TP53 P04637 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL15071141 0.99 F2RL1 (0.61) F2RL1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL15071136 0.90 F2RL1 (0.62) F2RL1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL31488 0.90 F2RL1 (0.60) F2RL1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL15071131 0.89 F2RL1 (0.61) F2RL1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL15071100 0.89 F2RL1 (0.77) F2RL1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL15071144 0.89 F2RL1 (0.60) F2RL1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL31533 0.88 F2RL1 (0.82) F2RL1KMT2AGRM5
SCHEMBL15071137 0.88 F2RL1 (0.59) F2RL1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL15071143 0.87 F2RL1 (0.74) F2RL1HPGDNPC1RAB9ASMN1; SMN2
SCHEMBL15071132 0.86 F2RL1 (0.64) F2RL1HPGDNPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2617721-A2 NOVEL HETEROCYCLIC COMPOUND, AND COMPOSITION FOR TREATING INFLAMMATORY DISEASES USING SAME Neopharm Co., Ltd. (KR) 2013-07-24 EP disclosed
US-20130165652-A1 NOVEL HETEROCYCLIC COMPOUND, AND COMPOSITION FOR TREATING INFLAMMATORY DISEASES USING SAME NEOPHARM CO.,LTD. (KR) 2013-06-27 US disclosed
US-20130165652-A1 NOVEL HETEROCYCLIC COMPOUND, AND COMPOSITION FOR TREATING INFLAMMATORY DISEASES USING SAME NEOPHARM CO.,LTD. (KR) 2013-06-27 US disclosed
WO-2012026765-A2 NOVEL HETEROCYCLIC COMPOUND, AND COMPOSITION FOR TREATING INFLAMMATORY DISEASES USING SAME (주)네오팜 (KR) 2012-03-01 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-20130165652-A1 NOVEL HETEROCYCLIC COMPOUND, AND COMPOSITION FOR TREATING INFLAMMATORY DISEASES USING SAME F2RL1, F2R, FPR2 F2RL1 1/4885HPGD 80/4885NPC1 2008/4885

“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.