SCHEMBL11685395

SCHEMBL11685395

O=C(O)C(NC(=O)N1CCNC1=O)c1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ CCKBR P32239 1/20 0.44
▸ LMNA P02545 1/20 0.42
▸ CRHBP P24387 1/20 0.40
▸ CRHR2 Q13324 1/20 0.40
▸ GPR6 P46095 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CACNA2D1 P54289 1/20 0.38
▸ CACNA1B Q00975 1/20 0.38
▸ CACNB1 Q02641 1/20 0.38
▸ GAA P10253 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ SLC6A9 P48067 1/20 0.35
▸ CYP2D6 P10635 1/20 0.34
▸ CYP19A1 P11511 1/20 0.34

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
SCHEMBL11688417 0.92 KLK5 (0.42) MEN1KMT2ACCKBRLMNACRHBP
SCHEMBL11011053 0.88 KMT2A (0.45) MEN1KMT2ACCKBRLMNAALDH1A1
SCHEMBL10674145 0.88 MEN1 (0.53) MEN1KMT2ACCKBRLMNAALDH1A1
SCHEMBL10564270 0.88 MEN1 (0.53) MEN1KMT2ACCKBRLMNAALDH1A1
SCHEMBL11684557 0.87 KMT2A (0.46) MEN1KMT2ACCKBRLMNAALDH1A1
SCHEMBL11686286 0.84 MEN1 (0.44) MEN1KMT2ACCKBRLMNAALDH1A1
SCHEMBL11688469 0.83 MEN1 (0.43) MEN1KMT2ACCKBRLMNAALDH1A1
SCHEMBL11773759 0.80 MEN1 (0.47) MEN1KMT2ACCKBRLMNAALDH1A1
SCHEMBL10751872 0.80 MEN1 (0.52) MEN1KMT2ACCKBRLMNAGPR6
SCHEMBL11688628 0.80 ALDH1A1 (0.43) MEN1KMT2ACCKBRLMNACRHBP

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-4016282-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-04-05 — — US disclosed
US-3980792-A EFFECTIVE AGAINST GRAM-NEGATIVE AND GRAM-POSITIVE INFECTIONS BAYER AKTIENGESELLSCHAFT (DT) 1976-09-14 — — US disclosed
US-3978223-A UREIDOACETAMIDO-PENICILLINS FOR TREATING BACTERIAL INFECTIONS BAYER AKTIENGESELLSCHAFT (DT) 1976-08-31 — — US disclosed
US-3974140-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-10 — — US disclosed
US-3959258-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-05-25 — — US disclosed
US-3939149-A BACTERICIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-02-17 — — US disclosed
US-3936442-A ANTIBIOTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-02-03 — — US disclosed
US-3933795-A Ureidoacetamido-penicillins Konig, Hans-Bodo (DT) 1976-01-20 — — US disclosed
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