SCHEMBL12596507

SCHEMBL12596507

CC(C)(C)c1ccc(S(=O)(=O)c2ccc(Oc3ccc(C(c4ccc(O)cc4)(C(F)(F)F)C(F)(F)F)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 6/20 0.50
▸ ELANE P08246 2/20 0.50
▸ GAA P10253 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ ESR1 P03372 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ UQCRB P14927 1/20 0.46
▸ LMNA P02545 1/20 0.43
▸ TYR P14679 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ RORA P35398 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39

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
SCHEMBL14288322 0.93 ESR1 (0.56) HSD11B1ELANEGAAPKMESR1
SCHEMBL12531593 0.90 ELANE (0.59) HSD11B1ELANEGAAPKMESR1
SCHEMBL12531631 0.90 ELANE (0.59) HSD11B1ELANEGAAPKMESR1
SCHEMBL12199023 0.90 ELANE (0.59) HSD11B1ELANEGAAPKMESR1
SCHEMBL12676446 0.90 ELANE (0.59) HSD11B1ELANEGAAPKMESR1
SCHEMBL12676698 0.90 ELANE (0.59) HSD11B1ELANEGAAPKMESR1
SCHEMBL12676583 0.90 ELANE (0.59) HSD11B1ELANEGAAPKMESR1
SCHEMBL12451153 0.89 PKM (0.65) HSD11B1ELANEGAAPKMESR1
SCHEMBL10052278 0.88 HSD11B1 (0.51) HSD11B1ELANEGAAPKMESR1
SCHEMBL19392509 0.86 HSD11B1 (0.47) HSD11B1ELANEGAAPKMLMNA

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-3577164-B1 POLYARYLENE ETHER SULFONE COMPRISING NAPHTHALIC ACID ANHYDRIDE ENDGROUPS BASF SE (DE) 2021-06-02 — — EP disclosed
EP-2358787-B1 METHOD FOR PREPARING A REACTIVE POLYARYLENE ETHER BASF SE (DE) 2013-01-09 — — EP disclosed
EP-2336220-A1 Improved blends of polyarylene ethers and polyarylene sulphides BASF SE (DE) 2011-06-22 — — EP disclosed
EP-1681311-B1 Branched sulfonated polyarylether BASF AG (DE) 2007-11-28 — — EP disclosed
Send feedback