SCHEMBL6773814

SCHEMBL6773814

O=C(Nc1ccc(Cl)cn1)c1ncccc1NCC1CCNCC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 5/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ PIM1 P11309 1/20 0.44
▸ PIM3 Q86V86 1/20 0.44
▸ PIM2 Q9P1W9 1/20 0.44
▸ FLT3 P36888 1/20 0.44
▸ ALOX15 P16050 1/20 0.43
▸ CHEK1 O14757 1/20 0.43
▸ MAPT P10636 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ CHRM3 P20309 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
SCHEMBL6107029 0.88 F10 (0.55) F10SMN1; SMN2ALOX15CHEK1RAB9A
SCHEMBL6773080 0.83 F10 (0.52) F10SMN1; SMN2
SCHEMBL6106818 0.82 F10 (0.58) F10
SCHEMBL6106785 0.79 F10 (0.52) F10SMN1; SMN2FLT3CHEK1RAB9A
SCHEMBL6110502 0.79 F10 (0.50) F10CHEK1
SCHEMBL6107921 0.79 F10 (0.52) F10SMN1; SMN2ALOX15CHEK1RAB9A
SCHEMBL7447691 0.79 AKT1 (0.46) F10SMN1; SMN2ALOX15MAPTRAB9A
Trifluoroacetic Acid SCHEMBL6769487 0.79 F10 (0.47) F10SMN1; SMN2MAPTRAB9A
SCHEMBL7360534 0.77 CHEK1 (0.45) SMN1; SMN2PIM1CHEK1
SCHEMBL6108227 0.77 CHEK1 (0.50) F10SMN1; SMN2ALOX15CHEK1MAPT

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
US-6689780-B1 PYRIDINE DERIVATIVES ELI LILLY AND COMPANY 2004-02-10 — — US disclosed
EP-1140905-B1 HETEROAROMATIC AMIDES AS INHIBITOR OF FACTOR XA LILLY CO ELI (US) 2003-05-14 — — EP disclosed
EP-1140905-A1 HETEROAROMATIC AMIDES AS INHIBITOR OF FACTOR XA ELI LILLY AND COMPANY (US) 2001-10-10 — — EP disclosed
WO-2000039117-A1 HETEROROAROMATIC AMIDES AS INHIBITOR OF FACTOR Xa ELI LILLY AND COMPANY (US) 2000-07-06 — — WO disclosed
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