Propane

Propane

SCHEMBL8099786

CCC.CNCCC(C)C

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.37
HRH1 P35367 2/20 0.37
KISS1R Q969F8 1/20 0.35
EPHX1 P07099 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.33
PRMT3 O60678 1/20 0.30
CARM1 Q86X55 1/20 0.30
PRMT6 Q96LA8 1/20 0.30
PRMT1 Q99873 1/20 0.30
PRMT8 Q9NR22 1/20 0.30
LMNA P02545 1/20 0.30
ANPEP P15144 2/20 0.30
RNPEP Q9H4A4 2/20 0.30
DNPEP Q9ULA0 1/20 0.30
CYP2D6 P10635 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
SCHEMBL388479 0.94
Hydrochloric Acid SCHEMBL2189668 0.90
Hydrochloric Acid SCHEMBL3819655 0.90
SCHEMBL23010220 0.80 HTR2A (0.33) HTR2AHRH1KISS1RCYP2D6
SCHEMBL21218130 0.78 LMNA (0.38) TRPM8LMNA
SCHEMBL21795199 0.77 KISS1R (0.33) HTR2AHRH1KISS1R
SCHEMBL23010168 0.77 KISS1R (0.33) HTR2AHRH1KISS1R
SCHEMBL18551184 0.77 KISS1R (0.33) HTR2AHRH1KISS1R
SCHEMBL19646488 0.77 LMNA (0.39) HTR2AHRH1KISS1RLMNA
SCHEMBL18788229 0.77 KISS1R (0.33) HTR2AHRH1KISS1R

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-6057371-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION VIRGINIA COMMONWEALTH UNIVERSITY (US) 2000-05-02 US claimed
EP-0591426-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1994-04-13 EP claimed
WO-1993000313-A2 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1993-01-07 WO claimed
US-6057371-A TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION VIRGINIA COMMONWEALTH UNIVERSITY (US) 2000-05-02 US disclosed
EP-0591426-A1 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1994-04-13 EP disclosed
WO-1993000313-A2 SIGMA RECEPTOR LIGANDS AND THE USE THEREOF VIRGINIA COMMONWEALTH UNIVERSITY (US) 1993-01-07 WO disclosed