SCHEMBL9779705

SCHEMBL9779705

CCCCC[C@H]1CC[C@H](c2ccc(-c3cc(C(=O)CC)ccc3-c3ccccc3F)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.42
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
CYP3A4 P08684 2/20 0.38
APP P05067 1/20 0.36
P2RY14 Q15391 1/20 0.36
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
KMT2A Q03164 1/20 0.36
RARB P10826 1/20 0.36
FASN P49327 1/20 0.35
DHODH Q02127 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL9779710 0.91 CYP2C9 (0.42) CYP2C9MAPTALDH1A1LMNACYP3A4
SCHEMBL9779457 0.91 RARB (0.45) CYP2C9MAPTALDH1A1LMNACYP3A4
SCHEMBL9779697 0.91 CYP2C9 (0.42) CYP2C9MAPTALDH1A1LMNACYP3A4
SCHEMBL10924253 0.85 MAPT (0.37) CYP2C9MAPTALDH1A1LMNAMEN1
SCHEMBL9779666 0.83 CYP2C9 (0.36) CYP2C9MAPTALDH1A1LMNACYP3A4
SCHEMBL9501064 0.82 CYP2C9 (0.40) CYP2C9MAPTALDH1A1LMNACYP3A4
SCHEMBL9561423 0.82 CYP2C9 (0.40) CYP2C9MAPTALDH1A1LMNACYP3A4
SCHEMBL9779634 0.81 KDM1A (0.37) CYP2C9CYP3A4KDM1A
SCHEMBL19441853 0.81 CYP2C9 (0.55) CYP2C9MAPTALDH1A1LMNACYP3A4
SCHEMBL13267822 0.79 CYP2C9 (0.59) CYP2C9MAPTALDH1A1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5061400-A WIDE TEMPERATURE RANGE, HIGH RESPONSE SPEED, LOW DRIVING VOLTAGE SEIKO EPSON CORPORATION (JP) 1991-10-29 US disclosed