SCHEMBL8150146

SCHEMBL8150146

CCOC(=O)CCCC(C)Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.53
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
NR1I2 O75469 1/20 0.43
PGR P06401 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
PTGS2 P35354 1/20 0.43
PDE4D Q08499 1/20 0.43
GAA P10253 2/20 0.43
MGAM O43451 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
MAPT P10636 1/20 0.42
CYP3A4 P08684 2/20 0.41
TSHR P16473 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 2/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL11451286 0.89 CYP1A2 (0.43) CYP1A2KMT2APOLBL3MBTL1NR1I2
SCHEMBL8148446 0.88 L3MBTL1 (0.50) CYP1A2KMT2APOLBL3MBTL1NR1I2
SCHEMBL7971197 0.84 CYP1A2 (0.53) CYP1A2KMT2APOLBL3MBTL1NR1I2
SCHEMBL127142 0.83 CYP1A2 (0.57) CYP1A2KMT2APOLBL3MBTL1NR1I2
SCHEMBL10879118 0.82 CYP1A2 (0.61) CYP1A2KMT2APOLBL3MBTL1NR1I2
SCHEMBL2112334 0.82 CYP1A2 (0.55) CYP1A2KMT2APOLBL3MBTL1NR1I2
SCHEMBL2112335 0.82 CYP1A2 (0.55) CYP1A2KMT2APOLBL3MBTL1NR1I2
SCHEMBL2915704 0.82 CYP1A2 (0.55) CYP1A2KMT2APOLBL3MBTL1NR1I2
Hydrochloric Acid SCHEMBL9474186 0.81 CYP1A2 (0.55) CYP1A2KMT2APOLBL3MBTL1NR1I2
SCHEMBL4178222 0.80 CYP1A2 (0.53) CYP1A2KMT2APOLBL3MBTL1NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6041157-A Environmentally sensitive compositions of matter based on 3H-fluoren-3-ylidenes and process for making same GOETZ FREDERICK JAMES (US) 2000-03-21 US disclosed
US-4281010-A FOR INCREASING BLOOD CIRCULATION DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1981-07-28 US disclosed
US-4254269-A PRECURSERS FOR CARDIOVASCULAR DRUGS DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1981-03-03 US disclosed
US-4206213-A IMPROVING PERIPHERAL AND CEREBRAL CIRCULATION DEUTSCHE GOLD- UND SILBER-SCHEIDEANSTALT VORMALS ROESSLER (DE) 1980-06-03 US disclosed