SCHEMBL8377385

SCHEMBL8377385

CC(C)(NC(=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.64
CYP3A4 P08684 6/20 0.64
ALDH1A1 P00352 6/20 0.64
SMN1; SMN2 Q16637 5/20 0.64
MAPT P10636 5/20 0.64
MAPK1 P28482 4/20 0.64
TSHR P16473 3/20 0.64
SHBG P04278 3/20 0.64
SERPINA6 P08185 3/20 0.64
NR3C1 P04150 3/20 0.64
PGR P06401 3/20 0.64
CYP2C9 P11712 2/20 0.64
HIF1A Q16665 2/20 0.64
ABCB11 O95342 2/20 0.64
NR1I2 O75469 2/20 0.64
NR3C2 P08235 2/20 0.64
MEN1 O00255 2/20 0.64
AR P10275 2/20 0.64
KMT2A Q03164 2/20 0.64
GPBAR1 Q8TDU6 2/20 0.64

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
SCHEMBL8377389 1.00 LMNA (0.64) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT
SCHEMBL8629925 0.90 LMNA (0.61) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT
SCHEMBL8629927 0.90 LMNA (0.61) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT
SCHEMBL2640199 0.90 SRD5A2 (0.63) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT
SCHEMBL2640197 0.90 SRD5A2 (0.63) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT
SCHEMBL8074444 0.90 SRD5A2 (0.63) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT
SCHEMBL8064125 0.89 SRD5A2 (0.64) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT
SCHEMBL8064116 0.89 SRD5A2 (0.64) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT
SCHEMBL6263252 0.88 LMNA (0.73) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT
SCHEMBL6263255 0.88 LMNA (0.73) LMNACYP3A4ALDH1A1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0902790-A1 PROCESS FOR PREPARING STEROIDS HAVING A CARBOXAMIDE SIDE-CHAIN PHARMACIA & UPJOHN S.p.A. (IT) 1999-03-24 EP disclosed
WO-1997040062-A1 PROCESS FOR PREPARING STEROIDS HAVING A CARBOXAMIDE SIDE-CHAIN PHARMACIA & UPJOHN S.P.A. (IT) 1997-10-30 WO disclosed