SCHEMBL7430789

SCHEMBL7430789

CCCCCCCCCCCC(=O)c1cc(O)c(Cl)c(Cl)c1Cl

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.54
▸ PLA2G2A P14555 2/20 0.53
▸ PLA2G5 P39877 2/20 0.53
▸ FFAR1 O14842 1/20 0.53
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ PAK1 Q13153 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ MAPT P10636 1/20 0.49
▸ ATM Q13315 1/20 0.49
▸ HSD17B3 P37058 6/20 0.46
▸ HPGD P15428 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ ELANE P08246 5/20 0.44
▸ CES2 O00748 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
SCHEMBL11603708 0.84 HTT (0.58) HTTPLA2G2APLA2G5FFAR1MEN1
SCHEMBL10356111 0.84 HTT (0.58) HTTPLA2G2APLA2G5FFAR1MEN1
SCHEMBL9717543 0.77 HTT (0.53) HTTMEN1KMT2APAK1ALDH1A1
SCHEMBL11295651 0.76 HTT (0.56) HTTPLA2G2APLA2G5FFAR1MEN1
SCHEMBL11079724 0.75 HTT (0.59) HTTPLA2G2APLA2G5FFAR1MEN1
SCHEMBL28688851 0.75 HTT (0.59) HTTPLA2G2APLA2G5FFAR1MEN1
SCHEMBL11301129 0.75 HTT (0.59) HTTPLA2G2APLA2G5FFAR1MEN1
SCHEMBL11075491 0.74 PLA2G2A (0.57) HTTPLA2G2APLA2G5FFAR1MEN1
SCHEMBL22500510 0.74 HTT (0.58) HTTPLA2G2APLA2G5FFAR1MEN1
SCHEMBL19296351 0.74 PLA2G2A (0.57) HTTPLA2G2APLA2G5FFAR1MEN1

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-0095295-B1 CYCLIC PEPTIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1987-01-14 — — EP disclosed
US-4537717-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1985-08-27 — — US disclosed
EP-0095295-A1 Cyclic peptide derivatives ELI LILLY AND COMPANY (US) 1983-11-30 — — EP disclosed
Send feedback