SCHEMBL11739896

SCHEMBL11739896

CC(=O)N1CCCN(C(=O)NC(C(=O)O)c2ccccc2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.41
▸ ATM Q13315 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ LMNA P02545 3/20 0.39
▸ TSHR P16473 1/20 0.39
▸ RAB9A P51151 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ RBP4 P02753 2/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC7 Q8WUI4 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ HDAC9 Q9UKV0 1/20 0.38
▸ HDAC5 Q9UQL6 1/20 0.38
▸ NOTUM Q6P988 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ EPHX2 P34913 1/20 0.37

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
SCHEMBL11733894 0.95 KMT2A (0.42) KMT2AATMMEN1ALDH1A1LMNA
SCHEMBL11733493 0.90 KMT2A (0.41) KMT2AATMMEN1ALDH1A1LMNA
SCHEMBL11732699 0.87 MEN1 (0.41) KMT2AATMMEN1ALDH1A1LMNA
SCHEMBL11731459 0.84 FOLH1 (0.43) KMT2AATMMEN1ALDH1A1RAB9A
SCHEMBL11734999 0.84 ATM (0.39) KMT2AATMMEN1ALDH1A1LMNA
SCHEMBL11730787 0.84 KMT2A (0.42) KMT2AATMMEN1ALDH1A1LMNA
SCHEMBL8068071 0.83 KMT2A (0.37) KMT2AMEN1ALDH1A1LMNATSHR
SCHEMBL11732221 0.83 GRIN2B (0.38) KMT2AMEN1ALDH1A1GAANOTUM
SCHEMBL11734433 0.83 SMN1; SMN2 (0.39) KMT2AATMMEN1ALDH1A1LMNA
SCHEMBL11737995 0.82 MEN1 (0.39) KMT2AATMMEN1ALDH1A1LMNA

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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