SCHEMBL9035844

SCHEMBL9035844

CCc1cccc(CC(=O)Br)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 1/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ LMNA P02545 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ MAPT P10636 3/20 0.41
▸ PTGS2 P35354 1/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ MGLL Q99685 1/20 0.41
▸ HDAC3 O15379 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC7 Q8WUI4 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ HDAC10 Q969S8 1/20 0.41
▸ HDAC11 Q96DB2 1/20 0.41
▸ HDAC8 Q9BY41 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ HDAC9 Q9UKV0 1/20 0.41

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
SCHEMBL13905068 0.82 BCL2 (0.47) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL1515871 0.82 AKR1B1 (0.58) BCL2LMNAHTTALDH1A1MAPT
SCHEMBL30352697 0.80 CTBP2 (0.57) LMNAALDH1A1TP53L3MBTL1
SCHEMBL8255903 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL12164760 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL7770954 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL6650513 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL7770956 0.80 LMNA (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
SCHEMBL17430659 0.80 BCL2 (0.46) BCL2SMN1; SMN2KMT2ALMNAHTT
Acetic Acid SCHEMBL27734248 0.79 BCL2 (0.56) BCL2SMN1; SMN2ALDH1A1MAPTPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0362902-B1 Process and intermediates for beta-lactam antibiotics HARVARD COLLEGE (US) 1996-01-17 — — EP disclosed
US-5091525-A 7beta- 2'-(R)-2'-(p-hydroxyphenyl-2'-amino-acetamido!-3-chloro -3-(1-carbadethiacephem)-4-carboxylic acid ELI LILLY AND COMPANY (US) 1992-02-25 — — US disclosed
CN-1015178-B PROCESS AND INTERMEDIATES FOR BETA-LACTAM ANTIBIOTICS HARVARD COLLEGE (US) 1991-12-25 — — CN disclosed
CN-1015103-B PROCESS FOR PREPARING 3-HALO-1-CARBO-3-CEPHEM-4-CARBOXYLIC ACID AND ITS DERIV. HARVARD COLLEGE (US) 1991-12-18 — — CN disclosed
EP-0209352-B1 PROCESS AND INTERMEDIATES FOR BETA-LACTAM ANTIBIOTICS THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1991-05-02 — — EP disclosed
EP-0211540-B1 INTERMEDIATES AND PROCESS FOR ANTIBIOTICS THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1990-05-16 — — EP disclosed
EP-0362902-A2 Process and intermediates for beta-lactam antibiotics THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1990-04-11 — — EP disclosed
US-4870169-A Intermediates for beta-lactam antibiotics PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1989-09-26 — — US disclosed
US-4820816-A 3-trifuoromethylsulfonyloxy-substituted 1-carbacephalosporins as intermediates for antibiotics PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1989-04-11 — — US disclosed
US-4778884-A REACTING TRIFLUOROMETHYLSULFONYLOXY COMPOUND WITH LITHIUM HALIDE IN APROTIC POLAR SOLVENT PRESIDENT & FELLOWS OF HARVARD COLLEGE (US) 1988-10-18 — — US disclosed
US-4775752-A Process and intermediates for beta-lactam antibiotics THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1988-10-04 — — US disclosed
US-4734495-A Process and intermediates for beta-lactam antibiotics PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1988-03-29 — — US disclosed
US-4673737-A ANTIBIOTICS/ HARVARD UNIVERSITY (US) 1987-06-16 — — US disclosed
US-4665171-A CARBACEPHALOSPORINS HARVARD UNIVERSITY (US) 1987-05-12 — — US disclosed
EP-0211540-A1 Intermediates and process for antibiotics THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1987-02-25 — — EP disclosed
CN-86105247-A Antibiotic intermediate and preparation method — 1987-02-04 — — CN disclosed
CN-86104783-A The method for preparing beta-Lactam antibiotics — 1987-02-04 — — CN disclosed
EP-0209352-A2 Process and intermediates for beta-lactam antibiotics THE PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 1987-01-21 — — EP disclosed
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