SCHEMBL7859201

SCHEMBL7859201

Cc1ccc(CCCNC(=O)[C@](C)(CCCN)N(OC(=O)C(F)(F)F)C(=O)[C@@H](N)CCc2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
MMP8 P22894 2/20 0.37
KMT2A Q03164 2/20 0.36
PKM P14618 1/20 0.36
MLYCD O95822 1/20 0.35
PLAAT3 P53816 1/20 0.35
PLAAT5 Q96KN8 1/20 0.35
PLAAT2 Q9NWW9 1/20 0.35
PLAAT4 Q9UL19 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35

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
SCHEMBL7859250 0.96 PLAAT3 (0.38) POLBMMP8PLAAT3PLAAT5PLAAT2
SCHEMBL7850398 0.96 POLB (0.44) POLBLMNACYP2C9CYP2C19MMP8
SCHEMBL7857950 0.89 RAB9A (0.38) POLBALDH1A1MMP8KMT2APLAAT3
SCHEMBL7857056 0.86 POLB (0.34) POLBOPRK1
SCHEMBL7859124 0.77 MMP2 (0.37)
SCHEMBL8175675 0.75 OPRM1 (0.34) POLBLMNAALDH1A1KMT2ANPC1
SCHEMBL7850354 0.75 MC4R (0.47) MMP8
SCHEMBL7859114 0.74 POLB (0.40) POLBLMNACYP2C9CYP2C19ALDH1A1
SCHEMBL7857961 0.73 POLB (0.42) POLBLMNACYP2C9CYP2C19ALDH1A1
SCHEMBL7857902 0.73 MLYCD (0.43) POLBLMNACYP2C9CYP2C19MMP8

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
US-6245746-B1 ADMINISTERING AMIDE MICROBIOCIDE ANTIBIOTIC MICROCIDE PHARMACEUTICALS, INC. 2001-06-12 US disclosed
US-6114310-A THERAPY FOR MICROBIAL INFECTIONS MICROCIDE PHARMACEUTICALS, INC. (US) 2000-09-05 US disclosed