SCHEMBL9504338

SCHEMBL9504338

CCC(N1CCCCC1)N1c2ccccc2Sc2ccc(C(=O)NCCC(C)C)cc21

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
TP53 P04637 4/20 0.49
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
CNR1 P21554 1/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
POLB P06746 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
NAMPT P43490 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.40
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39

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
SCHEMBL9331559 0.99 LMNA (0.57) LMNATP53MEN1KMT2ACNR1
Hydrochloric Acid SCHEMBL9331386 0.98 LMNA (0.56) LMNATP53MEN1KMT2ACNR1
SCHEMBL9331538 0.91 BCHE (0.46) LMNATP53MEN1KMT2ACNR1
Hydrochloric Acid SCHEMBL9332148 0.90 LMNA (0.45) LMNATP53MEN1KMT2ACNR1
SCHEMBL9504379 0.90 LMNA (0.45) LMNATP53MEN1KMT2ACNR1
SCHEMBL9501784 0.89 BCHE (0.47) LMNATP53MEN1KMT2ACNR1
Hydrochloric Acid SCHEMBL9784944 0.89 LMNA (0.44) LMNATP53MEN1KMT2ACNR1
SCHEMBL9759112 0.88 LMNA (0.44) LMNATP53MEN1KMT2ACNR1
Hydrochloric Acid SCHEMBL9784864 0.88 BCHE (0.47) LMNATP53MEN1KMT2ACNR1
Hydrochloric Acid SCHEMBL9759279 0.87 LMNA (0.43) LMNATP53MEN1KMT2ACNR1

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
EP-0346238-B1 ANALGESIC PHENOTHIAZINE DERIVATIVES RHONE-POULENC SANTE (FR) 1993-06-09 EP claimed
US-5049669-A Also diuretics RHONE-POULENC SANTE (FR) 1991-09-17 US claimed
US-5049669-A Also diuretics RHONE-POULENC SANTE (FR) 1991-09-17 US disclosed