SCHEMBL11230758

SCHEMBL11230758

CCCCCCCCCCCCC(CCN)OC(CCN)CCCCCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
ALDH1A1 P00352 1/20 0.46
TSHR P16473 1/20 0.46
EPHX1 P07099 1/20 0.46
SPHK1 Q9NYA1 1/20 0.43
OPRM1 P35372 1/20 0.41
GNAI3 P08754 1/20 0.40
GNAO1 P09471 1/20 0.40
GNAI1 P63096 1/20 0.40
LMNA P02545 1/20 0.38
RRM1 P23921 1/20 0.38

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
SCHEMBL11231051 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL9177110 1.00 DNM1 (0.46) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL10821710 0.91 DNM1 (0.52) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL1317403 0.88 TSHR (0.47) DNM1TSHRSPHK1OPRM1LMNA
SCHEMBL8526142 0.88 TSHR (0.47) DNM1TSHRSPHK1OPRM1LMNA
SCHEMBL574944 0.88 TSHR (0.47) DNM1TSHRSPHK1OPRM1LMNA
SCHEMBL20299940 0.88 TSHR (0.47) DNM1TSHRSPHK1OPRM1LMNA
SCHEMBL1932239 0.88 TSHR (0.47) DNM1TSHRSPHK1OPRM1LMNA
SCHEMBL211947 0.88 TSHR (0.47) DNM1TSHRSPHK1OPRM1LMNA
SCHEMBL196549 0.88 TSHR (0.47) DNM1TSHRSPHK1OPRM1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4352913-A EPOXY RESIN CURING AGENTS CIBA-GEIGY CORPORATION (US) 1982-10-05 US disclosed
US-4324739-A CURING AGENTS FOR POLYEPOXIDES CIBA-GEIGY CORPORATION (US) 1982-04-13 US disclosed