SCHEMBL628519

SCHEMBL628519

CNCC(C)(C)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
ALOX12 P18054 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SIGMAR1 Q99720 1/20 0.38
HSD17B10 Q99714 1/20 0.32
EPHX1 P07099 1/20 0.31
SSTR4 P31391 1/20 0.30
CYP1A2 P05177 1/20 0.30

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
SCHEMBL23894764 0.93 MEN1 (0.33) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL23418695 0.79 SMN1; SMN2 (0.42) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL20031048 0.76 SIGMAR1 (0.34) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL20671574 0.76 SIGMAR1 (0.34) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL6420681 0.74 SIGMAR1 (0.41) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL2994447 0.74 MEN1 (0.40) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL4639751 0.72 SMN1; SMN2 (0.39) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL1396813 0.72 ALDH1A1 (0.39) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL20841523 0.72 MEN1 (0.43) SMN1; SMN2MEN1ALDH1A1LMNAALOX12
SCHEMBL9555928 0.72 MEN1 (0.43) SMN1; SMN2MEN1ALDH1A1LMNAALOX12

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-0986384-B1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2012-02-22 EP disclosed
US-20100121023-A1 POLYMER HAVING A SULFONIC GROUP OR A SULFONATE GROUP AND AN AMIDE GROUP AND METHOD OF PRODUCING SAME CANON KABUSHIKI KAISHA (JP) 2010-05-13 US disclosed
EP-0986384-A4 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIV PITTSBURGH (US) 2004-09-15 EP disclosed
US-6310095-B1 INHIBITING OR TREATING CANCER, TREATING INTIMAL HYPERPLASIA ASSOCIATED WITH RESTENOSIS AND ATHEROSCLEROSIS, INHIBITING POST-TRANSLATIONAL MODIFICATION OF ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE AND/OR GERANYLGERANYLTRANSFERASE UNIVERSITY OF PITTSBURGH 2001-10-30 US disclosed
EP-0986384-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 2000-03-22 EP disclosed
WO-1998050029-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-11-12 WO disclosed