Propane

Propane

SCHEMBL8097570

CCC.CNCCCc1ccccc1

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.88
KMT2A Q03164 2/20 0.88
L3MBTL1 Q9Y468 1/20 0.80
SIGMAR1 Q99720 7/20 0.77
ATM Q13315 1/20 0.68
TAAR1 Q96RJ0 1/20 0.68
POLB P06746 2/20 0.53

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
SCHEMBL21677 0.96 MEN1 (0.95) MEN1KMT2AL3MBTL1SIGMAR1ATM
Hydrochloric Acid SCHEMBL6552954 0.93 MEN1 (1.00) MEN1KMT2AL3MBTL1SIGMAR1ATM
SCHEMBL8091034 0.90 MEN1 (0.78) MEN1KMT2AL3MBTL1SIGMAR1ATM
SCHEMBL22331586 0.89 MEN1 (0.84) MEN1KMT2AL3MBTL1SIGMAR1ATM
SCHEMBL680531 0.89 L3MBTL1 (1.00) MEN1KMT2AL3MBTL1SIGMAR1ATM
SCHEMBL18753914 0.88 L3MBTL1 (0.81) MEN1KMT2AL3MBTL1SIGMAR1ATM
SCHEMBL920070 0.87 SIGMAR1 (1.00) MEN1KMT2AL3MBTL1SIGMAR1ATM
SCHEMBL19391367 0.87 SIGMAR1 (1.00) MEN1KMT2AL3MBTL1SIGMAR1ATM
SCHEMBL15766433 0.87 SIGMAR1 (1.00) MEN1KMT2AL3MBTL1SIGMAR1ATM
SCHEMBL5911099 0.87 SIGMAR1 (1.00) MEN1KMT2AL3MBTL1SIGMAR1ATM

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
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