SCHEMBL7404085

SCHEMBL7404085

O=C(OS(=O)(=O)c1ccccc1)C1CCCN1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 1/20 0.43
▸ CYP3A4 P08684 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ DPP4 P27487 2/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ HTR2B P41595 1/20 0.40
▸ DPP8 Q6V1X1 1/20 0.40
▸ ANPEP P15144 1/20 0.39
▸ CTSC P53634 1/20 0.39
▸ SCN4A P35499 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ENPP3 O14638 3/20 0.39
▸ ENPP1 P22413 3/20 0.39
▸ CYP2C9 P11712 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ ENPP2 Q13822 2/20 0.38
▸ WNT3 P56703 2/20 0.37
▸ SFRP1 Q8N474 2/20 0.37

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
SCHEMBL8301422 1.00 ELANE (0.43) ELANECYP3A4CYP2D6CYP1A2CYP2C19
SCHEMBL27539865 0.96 KMT2A (0.44) ELANECYP3A4CYP2D6CYP1A2CYP2C19
SCHEMBL3803839 0.86 ENPP3 (0.41) CYP2D6CYP1A2SCN4AENPP3ENPP1
SCHEMBL9538667 0.86 ENPP3 (0.41) ELANEHTR2CHTR2BSCN4AKMT2A
SCHEMBL3060996 0.86 ENPP3 (0.41) CYP2D6CYP1A2SCN4AENPP3ENPP1
SCHEMBL8212865 0.83 DPP4 (0.45) DPP4TSHRHTR6KDM4E
SCHEMBL7070285 0.80 HTR2C (0.43) ELANEHTR2CSCN4AKMT2AKDM4E
SCHEMBL7754536 0.79 HTR2C (0.46) ELANECYP3A4CYP2D6CYP1A2CYP2C19
SCHEMBL5717063 0.79 ENPP3 (0.46) KMT2AENPP3ENPP1ENPP2
SCHEMBL5586750 0.79 PTGS2 (0.53) CYP3A4KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1105126-A2 SULFONAMIDES OF N-CONTAINING HETEROCYCLIC THIOESTERS FOR VISION AND MEMORY DISORDERS GPI NIL Holdings, Inc. (US) 2001-06-13 — — EP claimed
WO-2000009107-A2 SULFONAMIDES OF N-CONTAINING HETEROCYCLIC THIOESTERS FOR VISION AND MEMORY DISORDERS GPI NIL HOLDINGS, INC. (US) 2000-02-24 — — WO claimed
EP-1127049-A1 BRIDGED HETEROCYCLIC DERIVATIVES GPI NIL Holdings, Inc. (US) 2001-08-29 — — EP disclosed
EP-1105126-A2 SULFONAMIDES OF N-CONTAINING HETEROCYCLIC THIOESTERS FOR VISION AND MEMORY DISORDERS GPI NIL Holdings, Inc. (US) 2001-06-13 — — EP disclosed
WO-2000016603-A2 BRIDGED HETEROCYCLIC DERIVATIVES GPI NIL HOLDINGS, INC. (US) 2000-03-30 — — WO disclosed
EP-0983054-A1 HAIR GROWTH COMPOSITIONS AND USES GPI NIL Holdings, Inc. (US) 2000-03-08 — — EP disclosed
WO-2000009107-A2 SULFONAMIDES OF N-CONTAINING HETEROCYCLIC THIOESTERS FOR VISION AND MEMORY DISORDERS GPI NIL HOLDINGS, INC. (US) 2000-02-24 — — WO disclosed
WO-1998055090-A1 HAIR GROWTH COMPOSITIONS AND USES GUILFORD PHARMACEUTICALS INC. (US) 1998-12-10 — — WO disclosed
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