SCHEMBL9549440

SCHEMBL9549440

Cn1cccccccc1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
INMT O95050 3/20 0.37
NFKB1 P19838 1/20 0.30
QPCT Q16769 1/20 0.30
HSD17B10 Q99714 1/20 0.30
QPCTL Q9NXS2 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
SCHEMBL28225821 0.95 INMT (0.39) INMTNFKB1QPCTHSD17B10QPCTL
SCHEMBL1381 0.95
SCHEMBL27700370 0.91
SCHEMBL28184040 0.91
Hydrochloric Acid SCHEMBL28317200 0.91
SCHEMBL27721688 0.91
Water SCHEMBL28081578 0.91
Bromide SCHEMBL9093480 0.91
SCHEMBL27296039 0.91
SCHEMBL27646530 0.91

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-0288515-B1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS ISP INVESTMENTS INC. (US) 1993-05-05 EP disclosed
EP-0288515-A4 QUATERNIZED NITROGEN CONTAINING COMPOUNDS 1990-09-26 EP disclosed
US-4957731-A CONDITIONERS, QUATERNIZED LACTAMS GAF CHEMICALS CORPORATION (US) 1990-09-18 US disclosed
US-4885158-A Heat stable quaternized lactams having oxylated sulfur anions GAF CORPORATION (US) 1989-12-05 US disclosed
US-4883655-A HAIR OR SKIN CONDITIONING GAF CORPORATION (US) 1989-11-28 US disclosed
WO-1989010115-A1 HAIR PROCESSING ADDITIVES GAF CHEMICALS CORPORATION (US) 1989-11-02 WO disclosed
EP-0288515-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS. GAF CORP (US) 1988-11-02 EP disclosed
WO-1988002985-A1 QUATERNIZED NITROGEN CONTAINING COMPOUNDS GAF CORPORATION (US) 1988-05-05 WO disclosed