SCHEMBL11309239

SCHEMBL11309239

CCN(CC)CC.Cc1ccc(OC(=O)C(C(=O)NC2C(=O)N3C2SC(C)(C)C3C(=O)O)c2ccccc2)cc1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.57
▸ RECQL P46063 4/20 0.57
▸ TDP1 Q9NUW8 3/20 0.57
▸ HPGD P15428 2/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ POLB P06746 2/20 0.57
▸ TEK Q02763 1/20 0.57
▸ SLC15A2 Q16348 1/20 0.57
▸ LMNA P02545 5/20 0.56
▸ TSHR P16473 2/20 0.56
▸ PTGS1 P23219 3/20 0.53
▸ CYP3A4 P08684 4/20 0.51
▸ OPRK1 P41145 1/20 0.51
▸ THRB P10828 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ RARB P10826 1/20 0.49
▸ RARG P13631 1/20 0.49
▸ NR1H2 P55055 1/20 0.49
▸ NR1H3 Q13133 1/20 0.49

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
SCHEMBL11309237 1.00 KDM4E (0.57) KDM4ERECQLTDP1HPGDMEN1
SCHEMBL11308196 0.94 KDM4E (0.61) KDM4ERECQLTDP1HPGDMEN1
SCHEMBL11308192 0.94 KDM4E (0.61) KDM4ERECQLTDP1HPGDMEN1
Carbenicillin Phenyl SCHEMBL11310839 0.91 LMNA (0.64) KDM4ERECQLTDP1HPGDMEN1
Carbenicillin Phenyl SCHEMBL11310852 0.91 LMNA (0.64) KDM4ERECQLTDP1HPGDMEN1
Carbenicillin Indanyl SCHEMBL11307348 0.88 KDM4E (0.54) KDM4ERECQLTDP1HPGDMEN1
Carbenicillin Indanyl SCHEMBL11307350 0.88 KDM4E (0.54) KDM4ERECQLTDP1HPGDMEN1
SCHEMBL11311253 0.87 KDM4E (0.56) KDM4ERECQLTDP1HPGDMEN1
SCHEMBL11311249 0.87 KDM4E (0.56) KDM4ERECQLTDP1HPGDMEN1
Carbenicillin Phenyl SCHEMBL150615 0.85 KDM4E (0.68) KDM4ERECQLTDP1HPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4304717-A Process for the preparation of reactive penicillanic acid and cephalosporanic acid derivatives CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT (HU) 1981-12-08 — — US disclosed
US-4171303-A Process for the preparation of reactive penicillanic acid and cephalosporanic acid derivatives CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1979-10-16 — — US disclosed
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