SCHEMBL11075199

SCHEMBL11075199

[NH]C(=O)C(NC(=O)OCc1ccccc1)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.67
CTSS P25774 1/20 0.67
ATM Q13315 2/20 0.61
CTRB1 P17538 2/20 0.54
ALDH1A1 P00352 4/20 0.53
CYP1A2 P05177 2/20 0.53
OPRK1 P41145 2/20 0.52
CYP3A4 P08684 4/20 0.51
TSHR P16473 4/20 0.51
CASP1 P29466 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PPARG P37231 1/20 0.51
CYP2C9 P11712 4/20 0.50
CYP2C19 P33261 3/20 0.50
POLB P06746 1/20 0.50
LMNA P02545 1/20 0.50
CYP2D6 P10635 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL10969427 0.93 CTSL (0.60) CTSLCTSSATMCTRB1ALDH1A1
SCHEMBL11522376 0.89 CTSL (0.56) CTSLCTSSATMCTRB1ALDH1A1
SCHEMBL1362502 0.88 ATM (0.77) CTSLCTSSATMCTRB1ALDH1A1
SCHEMBL3255533 0.88 ATM (0.77) CTSLCTSSATMCTRB1ALDH1A1
SCHEMBL7719287 0.88 ATM (0.77) CTSLCTSSATMCTRB1ALDH1A1
SCHEMBL434233 0.88 ATM (0.77) CTSLCTSSATMCTRB1ALDH1A1
SCHEMBL10967446 0.86 ATM (0.54) CTSLCTSSATM
SCHEMBL17776392 0.85 ATM (0.65) CTSLCTSSATMCTRB1ALDH1A1
SCHEMBL7382189 0.85 CTSL (0.64) CTSLCTSSATMCTRB1ALDH1A1
Potassium Ion SCHEMBL11792419 0.85 CTSL (0.64) CTSLCTSSATMCTRB1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0040494-B1 CARBAPENAMS AND CARBAPEN-2-EMS AND PROCESS THEREFOR PFIZER INC. (US) 1984-02-15 EP claimed
US-4429128-A CARBAPENICILLINS, THIENAMYCINS, BACTERICIDES PFIZER INC. (US) 1984-01-31 US claimed
US-4348264-A Photocatalyzed process for producing carbapenams and carbapen-2-ems PFIZER INC. (US) 1982-09-07 US claimed
EP-0040494-A1 Carbapenams and carbapen-2-ems and process therefor PFIZER INC. (US) 1981-11-25 EP claimed
EP-0040494-B1 CARBAPENAMS AND CARBAPEN-2-EMS AND PROCESS THEREFOR PFIZER INC. (US) 1984-02-15 EP disclosed
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