SCHEMBL7647130

SCHEMBL7647130

COc1ccc2c(c1)=NCN=2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
CYP1A2 P05177 2/20 0.40
CYP2A6 P11509 1/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
ALDH1A1 P00352 4/20 0.39
POLB P06746 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 1/20 0.39
NQO2 P16083 1/20 0.39
CCR1 P32246 1/20 0.39
CCR5 P51681 1/20 0.39

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
SCHEMBL28555235 0.72 HTR5A (0.36) CA12CA1CA2CA7CA9
SCHEMBL12502594 0.71 HTR5A (0.35) CA12CA1CA2CA7CA9
SCHEMBL11862521 0.71 CA12 (0.43) CA12CA1CA2CA7CA9
SCHEMBL1064932 0.70 GFER (0.42) CA12CA1CA2CA7CA9
SCHEMBL1152547 0.70 CA1 (0.42) CA12CA1CA2CA7CA9
SCHEMBL28601244 0.65 MEN1 (0.36) MEN1KMT2AALDH1A1POLBKDM4E
SCHEMBL28566219 0.65 TP53 (0.36) CYP2A6ALDH1A1SMN1; SMN2LMNAHTR5A
SCHEMBL15130589 0.65 ALDH1A1 (0.40) CYP1A2MEN1KMT2AALDH1A1KDM4E
SCHEMBL29447161 0.65 CYP1A2 (0.79) CA12CA1CA2CA7CA9
SCHEMBL443070 0.65 CYP1A2 (0.79) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118142356-A Method for preparing ultrathin metal-organic framework film by steam-assisted in-situ conversion and separation application thereof 中国科学院大连化学物理研究所 2024-06-07 CN claimed
CN-116262207-A Method for electrochemically synthesizing metal-organic framework membrane and application of metal-organic framework membrane in gas separation 中国科学院大连化学物理研究所 2023-06-16 CN claimed
CN-112973456-A Two-dimensional metal organic framework nanosheet film, and preparation method and application thereof 中国科学院大连化学物理研究所 2021-06-18 CN claimed
US-5093132-A Antiulcer benzimidazole derivative with basic alkali metal or alkaline earth metal compound TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-03-03 US claimed
CN-118142356-A Method for preparing ultrathin metal-organic framework film by steam-assisted in-situ conversion and separation application thereof 中国科学院大连化学物理研究所 2024-06-07 CN disclosed
CN-116262207-A Method for electrochemically synthesizing metal-organic framework membrane and application of metal-organic framework membrane in gas separation 中国科学院大连化学物理研究所 2023-06-16 CN disclosed
CN-112973456-B Two-dimensional metal organic framework nanosheet film, and preparation method and application thereof 中国科学院大连化学物理研究所 2022-05-10 CN disclosed
CN-112973456-A Two-dimensional metal organic framework nanosheet film, and preparation method and application thereof 中国科学院大连化学物理研究所 2021-06-18 CN disclosed
EP-1259238-A1 STABLE ACID LABILE BENZIMIDAZOLE PHARMACEUTICAL COMPOSITIONS Deboeck, Arthur M. (US) 2002-11-27 EP disclosed
WO-2001037834-A1 STABLE ACID LABILE BENZIMIDAZOLE PHARMACEUTICAL COMPOSITIONS GALEPHAR PHARMACEUTICAL RESEARCH, INC. (US) 2001-05-31 WO disclosed