SCHEMBL7775047

SCHEMBL7775047

C=C(C)COP(=O)(CC)C(O)C[N+](C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 1/20 0.30
TSHR P16473 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM1 P11229 1/20 0.30
TBXA2R P21731 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
SCHEMBL572694 0.76 TSHR (0.33) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL1572912 0.74
SCHEMBL3504549 0.71 TSHR (0.33) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL1729378 0.67 LPAR3 (0.51)
Phosphoric Acid SCHEMBL8763232 0.67 SMN1; SMN2 (0.36) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL4820864 0.67 BTN3A1 (0.35) BTN3A1TSHR
SCHEMBL8467337 0.66 BTN3A1 (0.47) BTN3A1TSHR
SCHEMBL16227463 0.66
SCHEMBL14739089 0.65 SLC22A16 (0.35) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL4822138 0.65 BTN3A1 (0.34) BTN3A1TSHR

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
EP-0946352-B1 A PROCESS FOR PREPARING A SOFT, TINTED LENS HYDRON LTD (GB) 2001-07-25 EP disclosed
US-6048371-A Process for preparing soft tinted lenses HYDRON, LTD. (GB) 2000-04-11 US disclosed
EP-0946352-A1 A PROCESS FOR PREPARING A SOFT, TINTED LENS Hydron Limited (GB) 1999-10-06 EP disclosed
WO-1998023436-A1 A PROCESS FOR PREPARING A SOFT, TINTED LENS HYDRON LIMITED (GB) 1998-06-04 WO disclosed