Methane

Methane

SCHEMBL7997331

C.C.O=C(O)CCCCCc1nc2ccccc2s1

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.86
HTT P42858 2/20 0.86
ALOX15 P16050 1/20 0.86
LMNA P02545 1/20 0.62
HPGD P15428 7/20 0.62
RAB9A P51151 1/20 0.62
POLB P06746 1/20 0.60
ATM Q13315 1/20 0.60
SLC13A5 Q86YT5 1/20 0.55
GAA P10253 1/20 0.55
MAPK1 P28482 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
ALDH1A1 P00352 5/20 0.55
MAPT P10636 2/20 0.55
PKM P14618 2/20 0.55
KMT2A Q03164 1/20 0.55
DRD2 P14416 1/20 0.52
DRD4 P21917 1/20 0.52
DRD3 P35462 1/20 0.52
HSD17B10 Q99714 1/20 0.52

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
SCHEMBL7835167 0.99 SMN1; SMN2 (0.89) SMN1; SMN2HTTALOX15LMNAHPGD
SCHEMBL7835431 0.99 SMN1; SMN2 (0.89) SMN1; SMN2HTTALOX15LMNAHPGD
SCHEMBL6645560 0.97 SMN1; SMN2 (0.91) SMN1; SMN2HTTALOX15LMNAHPGD
SCHEMBL243430 0.93 SMN1; SMN2 (1.00) SMN1; SMN2HTTALOX15LMNAHPGD
SCHEMBL4700801 0.87 HTT (0.69) SMN1; SMN2HTTALOX15LMNAHPGD
SCHEMBL1269672 0.86 SMN1; SMN2 (0.82) SMN1; SMN2HTTALOX15LMNAHPGD
SCHEMBL4703104 0.85 HTT (0.71) SMN1; SMN2HTTALOX15LMNAHPGD
SCHEMBL27509034 0.84 SMN1; SMN2 (0.68) SMN1; SMN2HTTALOX15LMNAHPGD
SCHEMBL8593944 0.84 HTT (0.65) SMN1; SMN2HTTALOX15LMNAHPGD
SCHEMBL7829947 0.83 LMNA (0.67) SMN1; SMN2HTTALOX15LMNAHPGD

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-6277984-B1 USE AS FLUORESCENT MARKERS; FOR IMPARTING FLUORESCENCE TO BIOLOGICAL AND NONBIOLOGICAL MATERIALS TODETECT VARIOUS BIOLOGICAL OR OTHER MATERIALS BY PROCEDURES SUCH AS FLUORESCENCE MICROSCOPY CARNEGIE MELLON UNIVERSITY 2001-08-21 US disclosed
US-5986093-A FLUORESCENT DYES CARNEGIE MELLON UNIVERSITY (US) 1999-11-16 US disclosed
US-5981747-A FOR USE AS FLUORESCENT MARKERS CARNEGIE MELLON UNIVERSITY (US) 1999-11-09 US disclosed