SCHEMBL10673324

SCHEMBL10673324

CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)C(=NOCC(=O)OC(C)(C)C)c3cscn3)[C@H]2SC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1I2 O75469 6/20 0.62
▸ MAPT P10636 5/20 0.62
▸ SLC22A6 Q4U2R8 2/20 0.62
▸ SLC22A8 Q8TCC7 2/20 0.62
▸ SLC22A11 Q9NSA0 2/20 0.62
▸ ALB P02768 1/20 0.62
▸ PPARG P37231 1/20 0.62
▸ TDP1 Q9NUW8 8/20 0.53
▸ L3MBTL1 Q9Y468 5/20 0.53
▸ APEX1 P27695 3/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ LMNA P02545 2/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ PKM P14618 1/20 0.53
▸ ABCC4 O15439 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ RECQL P46063 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ HTR2C P28335 1/20 0.53

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
SCHEMBL11160973 0.93 NR1I2 (0.62) NR1I2MAPTSLC22A6SLC22A8SLC22A11
SCHEMBL10673263 0.93 NR1I2 (0.62) NR1I2MAPTSLC22A6SLC22A8SLC22A11
SCHEMBL10673255 0.93 NR1I2 (0.62) NR1I2MAPTSLC22A6SLC22A8SLC22A11
SCHEMBL10676259 0.91 NR1I2 (0.67) NR1I2MAPTSLC22A6SLC22A8SLC22A11
SCHEMBL10938717 0.90 NR1I2 (0.49) NR1I2MAPTSLC22A6SLC22A8SLC22A11
SCHEMBL10936533 0.89 NR1I2 (0.52) NR1I2MAPTSLC22A6SLC22A8SLC22A11
SCHEMBL10673536 0.89 NR1I2 (0.50) NR1I2MAPTSLC22A6SLC22A8SLC22A11
SCHEMBL10936510 0.89 NR1I2 (0.52) NR1I2MAPTSLC22A6SLC22A8SLC22A11
SCHEMBL10673518 0.89 NR1I2 (0.50) NR1I2MAPTSLC22A6SLC22A8SLC22A11
SCHEMBL10671707 0.89 TDP1 (0.49) NR1I2MAPTSLC22A6SLC22A8SLC22A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4736039-A ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1988-04-05 — — US disclosed
US-4649136-A BACTERICIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-03-10 — — US disclosed
EP-0071891-B1 NEW CEPHEM COMPOUNDS AND PROCESSES FOR PREPARATION THEREOF FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-12-03 — — EP disclosed
US-4515788-A BACTERICIDAL ANTIBIOTICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-05-07 — — US disclosed
EP-0071891-A2 New cephem compounds and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-02-16 — — EP disclosed
Send feedback