SCHEMBL6566323

SCHEMBL6566323

Cc1c(O)cccc1-c1ccc(C(=O)O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 5/20 0.46
RXRB P28702 3/20 0.46
FOLH1 Q04609 1/20 0.45
ALDH1A1 P00352 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
TTR P02766 2/20 0.44
EGFR P00533 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
RARB P10826 1/20 0.43
RARG P13631 1/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
RXRG P48443 1/20 0.42
BCL2 P10415 1/20 0.42
KDM6B O15054 1/20 0.42
ABCC4 O15439 1/20 0.42
KDM4A O75164 1/20 0.42
ABCB11 O95342 1/20 0.42
KDM5A P29375 1/20 0.42
BLVRB P30043 1/20 0.42

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
SCHEMBL30159253 0.84 NR1H4 (0.51) RXRARXRBFOLH1ALDH1A1SMN1; SMN2
SCHEMBL2951399 0.84 NR1H4 (0.51) RXRARXRBFOLH1ALDH1A1SMN1; SMN2
SCHEMBL10598796 0.81 TTR (0.52) RXRARXRBFOLH1ALDH1A1SMN1; SMN2
SCHEMBL6888946 0.81 EGFR (0.57) ALDH1A1EGFRTSHRKDM4AKDM4E
SCHEMBL25470904 0.81 BCL2L1 (0.58) ALDH1A1EGFRKDM4ELMNAHSD17B10
SCHEMBL2038730 0.81 HSD17B10 (0.64) RXRARXRBALDH1A1EGFRRARB
SCHEMBL29876739 0.81 HSD17B10 (0.64) RXRARXRBALDH1A1EGFRRARB
SCHEMBL31156157 0.81 SRD5A2 (0.47) RXRARXRBFOLH1ALDH1A1SMN1; SMN2
SCHEMBL2038942 0.81 MAP4K4 (0.46) RXRARXRBFOLH1ALDH1A1SMN1; SMN2
SCHEMBL28188905 0.81 TTR (0.61) RXRARXRBFOLH1ALDH1A1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1235777-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2004-06-16 EP disclosed
EP-1235777-A2 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 EP disclosed
WO-2001038303-A2 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 WO disclosed