Pempidine

Pempidine

SCHEMBL985310

CN1C(C)(C)CCCC1(C)C.OC1CCNCC1

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
NFKB1 P19838 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL3682539 0.85 GAA (0.32)
SCHEMBL8991967 0.81 TSHR (0.32) TSHR
Pempidine SCHEMBL217663 0.73 TSHR (0.58) TSHRNFKB1CYP2C19
Pempidine SCHEMBL4798468 0.73 TSHR (0.58) TSHRNFKB1CYP2C19
Pempidine SCHEMBL28926027 0.71 TSHR (0.58) TSHRNFKB1CYP2C19
SCHEMBL6663702 0.71 ESR2 (0.31) TSHR
Ethane SCHEMBL334565 0.71
Pempidine SCHEMBL5050688 0.71 TSHR (0.56) TSHRNFKB1CYP2C19
Pempidine SCHEMBL988172 0.71 TSHR (0.56) TSHRNFKB1CYP2C19
Pempidine SCHEMBL27584101 0.71 TSHR (0.56) TSHRNFKB1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7862746-B2 Stabilization of natural composites BASF SE. (DE) 2011-01-04 US claimed
WO-2006087269-A1 STABILIZATION OF NATURAL COMPOSITES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-08-24 WO claimed
US-20060183821-A1 Stabilization of natural composites CIBA CORPORATION 2006-08-17 US claimed
US-7862746-B2 Stabilization of natural composites BASF SE. (DE) 2011-01-04 US disclosed
WO-2006087269-A1 STABILIZATION OF NATURAL COMPOSITES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2006-08-24 WO disclosed
US-20060183821-A1 Stabilization of natural composites CIBA CORPORATION 2006-08-17 US disclosed