SCHEMBL7930527

SCHEMBL7930527

CC1C2=C(CCCC2)C2=C1C([Ti+](OC(=O)C(c1ccccc1)(c1ccccc1)c1ccccc1)OC(=O)C(c1ccccc1)(c1ccccc1)c1ccccc1)CCC2.C[O-]

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.35
ALDH1A1 P00352 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
Hydrochloric Acid SCHEMBL7925099 0.97 KCNN4 (0.35) KCNN4ALDH1A1
SCHEMBL7927220 0.84
SCHEMBL7924500 0.84 CHRNA7 (0.31) ALDH1A1
SCHEMBL7924942 0.82 KCNN4 (0.35) KCNN4ALDH1A1
Hydrochloric Acid SCHEMBL7930316 0.81
SCHEMBL7924937 0.81 KCNN4 (0.42) KCNN4ALDH1A1
Hydrochloric Acid SCHEMBL7928369 0.81 CHRNA7 (0.32) ALDH1A1
SCHEMBL7927359 0.80 KCNN4 (0.35) KCNN4ALDH1A1
SCHEMBL7930505 0.80
Hydrochloric Acid SCHEMBL7924760 0.78 KCNN4 (0.34) KCNN4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0867454-B1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN CO (JP) 2001-03-21 EP disclosed
US-6075102-A Polymerization catalyst and process for producing polymers IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed