SCHEMBL6554476

SCHEMBL6554476

Cc1cc(C(=O)NC(C)c2cc(C#N)ccc2OCc2ccccc2)ccc1C(=O)N1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.45
MRGPRX4 Q96LA9 1/20 0.43
ACACB O00763 1/20 0.43
MET P08581 2/20 0.42
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PTGER1 P34995 5/20 0.40
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
CHRM2 P08172 1/20 0.39
HPGD P15428 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.38
CYP19A1 P11511 1/20 0.38

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
SCHEMBL6340535 0.91 SLC6A9 (0.44) SLC6A9MRGPRX4ACACBMETHSD17B10
SCHEMBL6554549 0.84 SLC6A9 (0.46) SLC6A9MRGPRX4METNPC1RAB9A
SCHEMBL7116842 0.83 MET (0.45) SLC6A9MRGPRX4ACACBMETHSD17B10
Hydrochloric Acid SCHEMBL6554810 0.83 SLC6A9 (0.45) SLC6A9MRGPRX4METNPC1RAB9A
SCHEMBL5099764 0.76 MET (0.46) SLC6A9MRGPRX4METNPC1RAB9A
Hydrochloric Acid SCHEMBL6342450 0.76 NPC1 (0.41) ACACBHSD17B10NPC1RAB9AHPGD
SCHEMBL7117570 0.75 MET (0.45) SLC6A9MRGPRX4METNPC1RAB9A
SCHEMBL6332084 0.75 SLC6A9 (0.43) SLC6A9MRGPRX4METHSD17B10NPC1
SCHEMBL6554651 0.75 HPGD (0.45) SLC6A9MRGPRX4METNPC1RAB9A
SCHEMBL6555829 0.75 ACACB (0.42) ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1390357-A2 ANTI-THROMBOTIC COMPOUNDS, PRODUCTION AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co. KG (DE) 2004-02-25 EP disclosed
US-20020151534-A1 Antithrombotic compounds BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-10-17 US disclosed
WO-2002062778-A2 ANTI-THROMBOTIC COMPOUNDS, PRODUCTION AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-08-15 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-20020151534-A1 Antithrombotic compounds SERPINC1, PF4, F2 SLC6A9 4643/4885MRGPRX4 2050/4885ACACB 2861/4885

“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.