SCHEMBL11733978

SCHEMBL11733978

CCS(=O)(=O)N1CCN(C(=O)NC(C(=O)O)c2ccccc2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ RBP4 P02753 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ NAALAD2 Q9Y3Q0 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ CCKBR P32239 1/20 0.36
▸ LTA4H P09960 1/20 0.36
▸ ANPEP P15144 1/20 0.36

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
SCHEMBL11731751 0.93 SMN1; SMN2 (0.40) SMN1; SMN2MEN1KMT2AATMCA1
SCHEMBL11730525 0.92 GAA (0.39) SMN1; SMN2MEN1KMT2AATMCA1
SCHEMBL11728497 0.90 LMNA (0.36) SMN1; SMN2MEN1KMT2ACA1CA2
SCHEMBL10759071 0.88 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2AATMCA1
SCHEMBL10674321 0.88 SMN1; SMN2 (0.41) SMN1; SMN2MEN1KMT2AATMCA1
SCHEMBL11732678 0.86 SMN1; SMN2 (0.39) SMN1; SMN2MEN1KMT2AATMCA1
SCHEMBL11736288 0.85 GAA (0.37) SMN1; SMN2MEN1KMT2AATMCA1
SCHEMBL11734412 0.84 SMN1; SMN2 (0.47) SMN1; SMN2MEN1KMT2AATMCA1
SCHEMBL11730461 0.83 ATM (0.38) SMN1; SMN2MEN1KMT2AATMALDH1A1
SCHEMBL11728164 0.82 SMN1; SMN2 (0.46) SMN1; SMN2MEN1KMT2ACA1CA2

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
US-4009272-A ANTIBIOTIC BAYER AKTIENGESELLSCHAFT (DT) 1977-02-22 — — US disclosed
US-3983105-A Penicillins BAYER AKTIENGESELLSCHAFT (DT) 1976-09-28 — — US disclosed
US-3978056-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-31 — — US disclosed
US-3975375-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-17 — — US disclosed
US-3974142-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-10 — — US disclosed
US-3974141-A IMIDAZOLIDINYL-CARBAMIDOBACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-10 — — US disclosed
US-3972869-A Penicillins BAYER AKTIENGESELLSCHAFT (DT) 1976-08-03 — — US disclosed
US-3972870-A IMIDAZOLIDINYL-CARBAMIDO-BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-03 — — US disclosed
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