SCHEMBL11079544

SCHEMBL11079544

CC1=C(C(=O)OC(c2ccccc2)c2ccccc2)N2C(=O)C(NC(=O)C(NC(=O)OCc3ccccc3)c3ccccc3)[C@H]2SC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLCG1 P19174 1/20 0.55
▸ ALDH1A1 P00352 3/20 0.54
▸ HSD17B10 Q99714 3/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ MAPT P10636 2/20 0.54
▸ SLC15A2 Q16348 2/20 0.54
▸ TDP1 Q9NUW8 2/20 0.54
▸ BLM P54132 1/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ADRA1A P35348 1/20 0.54
▸ HTR2B P41595 1/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.53
▸ PTGS1 P23219 1/20 0.48
▸ ESR1 P03372 1/20 0.48
▸ SLC22A6 Q4U2R8 1/20 0.48
▸ SLC22A8 Q8TCC7 1/20 0.48
▸ LMNA P02545 1/20 0.48

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
SCHEMBL11080633 0.92 ALDH1A1 (0.64) PLCG1ALDH1A1HSD17B10MAPK1KMT2A
SCHEMBL9807357 0.88 KMT2A (0.64) PLCG1ALDH1A1HSD17B10MAPK1KMT2A
SCHEMBL9807370 0.88 KMT2A (0.64) PLCG1ALDH1A1HSD17B10MAPK1KMT2A
SCHEMBL11592032 0.88 PLCG1 (0.74) PLCG1ALDH1A1HSD17B10MAPK1KMT2A
SCHEMBL11079715 0.88 PLCG1 (0.53) PLCG1ALDH1A1HSD17B10MAPK1KMT2A
SCHEMBL11077948 0.88 PLCG1 (0.57) PLCG1ALDH1A1HSD17B10MAPK1KMT2A
SCHEMBL11077945 0.88 PLCG1 (0.57) PLCG1ALDH1A1HSD17B10MAPK1KMT2A
SCHEMBL11288008 0.87 ALDH1A1 (0.55) ALDH1A1HSD17B10MAPK1KMT2AMAPT
SCHEMBL11852853 0.86 HSD17B10 (0.59) PLCG1ALDH1A1HSD17B10MAPK1KMT2A
SCHEMBL11414559 0.84 ALDH1A1 (0.56) PLCG1ALDH1A1HSD17B10MAPK1KMT2A

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-4429128-A CARBAPENICILLINS, THIENAMYCINS, BACTERICIDES PFIZER INC. (US) 1984-01-31 — — US disclosed
US-4348264-A Photocatalyzed process for producing carbapenams and carbapen-2-ems PFIZER INC. (US) 1982-09-07 — — US disclosed
EP-0040494-A1 Carbapenams and carbapen-2-ems and process therefor PFIZER INC. (US) 1981-11-25 — — EP disclosed
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