SCHEMBL8879447

SCHEMBL8879447

CCOC(=O)C1CC(O)CN1C(=O)Cc1ccc(C)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
VHL P40337 1/20 0.40
APOBEC3A P31941 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.36
P2RX7 Q99572 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MDM2 Q00987 1/20 0.35
HPGD P15428 1/20 0.35
CACNA1A O00555 1/20 0.35
CACNA2D1 P54289 1/20 0.35
CACNB1 Q02641 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 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
SCHEMBL8875741 0.91 ALDH1A1 (0.38) POLBKMT2AALDH1A1LMNAP2RX7
SCHEMBL8877111 0.88 ALDH1A1 (0.37) POLBKMT2AALDH1A1LMNAP2RX7
SCHEMBL8876139 0.85 VHL (0.42) POLBCYP1A2CYP3A4CYP2C19VHL
SCHEMBL8877501 0.84 MDM2 (0.39) POLBAPOBEC3AAPOBEC3GKMT2AALDH1A1
SCHEMBL8877150 0.83 POLB (0.39) POLBAPOBEC3AAPOBEC3GKMT2AALDH1A1
SCHEMBL8317318 0.82 POLB (0.35) POLBCYP1A2CYP3A4CYP2C19VHL
SCHEMBL8877689 0.82 TSHR (0.42) POLBVHLKMT2AALDH1A1LMNA
SCHEMBL8876496 0.80 KMT2A (0.40) POLBVHLAPOBEC3AAPOBEC3GKMT2A
SCHEMBL9727473 0.80 FKBP1A (0.47) POLBKMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL9724044 0.80 P2RX7 (0.36) POLBKMT2AALDH1A1LMNAP2RX7

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
US-5693663-A PESTICIDES; HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-02 US disclosed
US-5585384-A 1-OXY-FUNCTIONAL GROUP-2-ALKYLARYL-3-OXO-PYRROLIZINES; INSECTICIDES; NEMATOCIDES; HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1996-12-17 US disclosed
US-5288874-A Insecticides, miticides BAYER AKTIENGESELLSCHAFT (DE) 1994-02-22 US disclosed