SCHEMBL6631344

SCHEMBL6631344

O=C(c1ccccc1)N1CCC2(CCCNC2)C1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.67
NAMPT P43490 7/20 0.67
L3MBTL3 Q96JM7 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
ALDH1A1 P00352 6/20 0.57
CYP3A4 P08684 5/20 0.57
USP2 O75604 4/20 0.57
CYP2D6 P10635 4/20 0.57
CYP1A2 P05177 2/20 0.57
CYP2C9 P11712 1/20 0.53
TSHR P16473 1/20 0.53
TP53 P04637 1/20 0.52
HPGD P15428 1/20 0.52
MAPK1 P28482 1/20 0.52
CYP2C19 P33261 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
SIGMAR1 Q99720 1/20 0.51
MGLL Q99685 1/20 0.51

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
SCHEMBL6634743 0.92 HSD17B10 (0.60) HSD17B10NAMPTL3MBTL3L3MBTL1ALDH1A1
SCHEMBL14742135 0.92 NAMPT (0.66) HSD17B10NAMPTL3MBTL3L3MBTL1SIGMAR1
SCHEMBL7170178 0.89 NAMPT (0.67) HSD17B10NAMPTL3MBTL3L3MBTL1ALDH1A1
SCHEMBL17888477 0.87 GABRD (0.64) HSD17B10NAMPTL3MBTL3L3MBTL1ALDH1A1
SCHEMBL21214364 0.84 NAMPT (0.59) HSD17B10NAMPTL3MBTL3L3MBTL1ALDH1A1
SCHEMBL17886809 0.84 NAMPT (0.59) HSD17B10NAMPTL3MBTL3L3MBTL1ALDH1A1
SCHEMBL31748141 0.83 L3MBTL3 (0.58) HSD17B10NAMPTL3MBTL3L3MBTL1ALDH1A1
SCHEMBL7170182 0.83 NAMPT (0.65) NAMPTCYP2D6CYP1A2SIGMAR1MGLL
SCHEMBL6631346 0.83 L3MBTL3 (0.64) NAMPTL3MBTL3L3MBTL1SIGMAR1
SCHEMBL6634283 0.83 HSD11B1 (0.62) ALDH1A1CYP3A4USP2CYP2D6CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0854869-B1 SPIRO COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION LILLY CO ELI (US) 2004-08-25 EP disclosed
US-6528534-B2 Useful as glycoprotein IIb/IIIa antagonists for prophylaxis thrombosis, therapy of atheroschlerosis, arterioschlerosis, acute myocardial infarction, chronic stable angina, unstable angina, transient ischemic attacks and strokes MILLENNIUM PHARMACEUTICALS, INC. 2003-03-04 US disclosed
US-20020013325-A1 Spiro compounds as inhibitors of fibrinogen-dependent platelet aggregation FISHER MATTHEW J (US) 2002-01-31 US disclosed
US-6291469-B1 Spiro compounds as inhibitors of fibrinogen-dependent platelet aggregation ELI LILLY AND COMPANY 2001-09-18 US disclosed
EP-0854869-A1 SPIRO COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION ELI LILLY AND COMPANY (US) 1998-07-29 EP disclosed
WO-1997011940-A1 SPIRO COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION ELI LILLY AND COMPANY (US) 1997-04-03 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-20020013325-A1 Spiro compounds as inhibitors of fibrinogen-dependent platelet aggregation PF4, PFKP, SELP HSD17B10 1401/4885NAMPT 1424/4885L3MBTL3 4859/4885

“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.