SCHEMBL11309756

SCHEMBL11309756

O=COC(=O)Cc1cccs1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.50
▸ MEN1 O00255 4/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ L3MBTL1 Q9Y468 7/20 0.49
▸ ALDH1A1 P00352 5/20 0.49
▸ POLB P06746 5/20 0.49
▸ MAPT P10636 2/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ HPGD P15428 3/20 0.49
▸ CYP2C19 P33261 2/20 0.49
▸ RAB9A P51151 4/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ SLC1A3 P43003 1/20 0.46
▸ SLC1A2 P43004 1/20 0.46
▸ SLC1A1 P43005 1/20 0.46
▸ CASP3 P42574 1/20 0.45
▸ SENP8 Q96LD8 1/20 0.45

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
SCHEMBL5794329 0.88 NPC1 (0.49) NPC1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL8903536 0.84 L3MBTL1 (0.49) NPC1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL6960073 0.81 NPC1 (0.53) NPC1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL11217076 0.81 NPC1 (0.55) NPC1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL27773069 0.79 NPC1 (0.54) NPC1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL6241173 0.78 L3MBTL1 (0.52) NPC1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL236205 0.78 HPGD (0.56) NPC1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL11578766 0.78 SMN1; SMN2 (0.57) NPC1L3MBTL1ALDH1A1POLBTDP1
Hydrochloric Acid SCHEMBL27610313 0.76 HPGD (0.54) NPC1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL20464033 0.75 L3MBTL1 (0.50) NPC1MEN1KMT2AL3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4281116-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1981-07-28 — — US disclosed
US-4260745-A 3-Halo cephalosporins ELI LILLY AND COMPANY (US) 1981-04-07 — — US disclosed
US-4252950-A ANTIBIOTICS, BACTERICIDES, FUNGICIDES ELI LILLY AND COMPANY (US) 1981-02-24 — — US disclosed
US-4208515-A 3-Halo cephalosporins ELI LILLY AND COMPANY (US) 1980-06-17 — — US disclosed
US-4065618-A Process for 3-H-3-cephem esters ELI LILLY AND COMPANY (US) 1977-12-27 — — US disclosed
US-4065621-A Process for 3-alkyl and 3-phenyl cephalosporins ELI LILLY AND COMPANY (US) 1977-12-27 — — US disclosed
US-4064343-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1977-12-20 — — US disclosed
US-4013651-A 3-SUBSTITUTED AMINO-CEPHALOSPORINS ELI LILLY AND COMPANY (US) 1977-03-22 — — US disclosed
US-3992377-A 3-Thio-substituted cephalosporin antibiotics ELI LILLY AND COMPANY (US) 1976-11-16 — — US disclosed
US-3985737-A ANTIBACTERIAL AGENTS ELI LILLY AND COMPANY (US) 1976-10-12 — — US disclosed
US-3962227-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1976-06-08 — — US disclosed
Send feedback