SCHEMBL9374161

SCHEMBL9374161

CCC(C(=O)O)c1nn(CC#N)c(=O)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.43
▸ MAPT P10636 1/20 0.42
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ LMNA P02545 3/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GAA P10253 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ TSHR P16473 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
SCHEMBL8128443 0.73 MAPT (0.68) ALOX15MAPTKMT2ATSHR
SCHEMBL9374682 0.72 KMT2A (0.40) ALOX15MAPTMEN1KMT2ALMNA
SCHEMBL9374679 0.71 MEN1 (0.39) ALOX15MAPTMEN1KMT2ALMNA
SCHEMBL9583905 0.70 AKR1B1 (0.66) —
SCHEMBL9374155 0.70 RECQL (0.76) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL9530036 0.70 POLB (0.67) MEN1KMT2ALMNANPSR1SMN1; SMN2
SCHEMBL9674812 0.69 AKR1B1 (0.67) —
SCHEMBL10584475 0.69 AKR1B1 (0.67) —
SCHEMBL29868109 0.65 KDM4E (0.48) SMN1; SMN2ALDH1A1GAAKDM4ERAB9A
SCHEMBL4983840 0.65 HIF1A (0.42) MAPTLMNANPSR1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0397350-B1 Process and intermediates for the preparation of oxophthalazinyl acetic acids and analogs thereof PFIZER (US) 1994-04-06 — — EP disclosed
EP-0295051-B1 PREPARATION OF OXOPHTHALAZINYL ACETIC ACIDS HAVING BENZOTHIAZOLE OR OTHER HETEROCYCLIC SIDE CHAINS PFIZER INC. (US) 1993-06-09 — — EP disclosed
US-5182391-A Process and intermediates for the preparation of oxophthalazinyl acetic acids and analogs thereof PFIZER INC. (US) 1993-01-26 — — US disclosed
US-5171862-A Process and indazole intermediates for the preparation of oxophthalazinyl acetic acids and analogs thereof PFIZER INC. (US) 1992-12-15 — — US disclosed
US-5075442-A Process and intermediates for the preparation of oxophthalazinyl acetic acids and analogs thereof PFIZER INC. (US) 1991-12-24 — — US disclosed
EP-0397350-A1 Process and intermediates for the preparation of oxophthalazinyl acetic acids and analogs thereof PFIZER INC. (US) 1990-11-14 — — EP disclosed
US-4954629-A Process and intermediates for the preparation of oxophthalazinyl acetic acids and analogs thereof PFIZER INC. (US) 1990-09-04 — — US disclosed
US-4939140-A ALDOSE REDUCTASE INHIBITORS PFIZER INC. (US) 1990-07-03 — — US disclosed
US-4900844-A Intermediates for the preparation of oxophthalazinyl acetic acids having benzothiazole or other heterocyclic side chains PFIZER INC. (US) 1990-02-13 — — US disclosed
US-4868301-A Processes and intermediates for the preparation of oxophthalazinyl acetic acids having benzothiazole or other heterocyclic side chains PFIZER INC. (US) 1989-09-19 — — US disclosed
EP-0322153-A2 Heterocyclic oxophtalazinyl acetic acids PFIZER INC. (US) 1989-06-28 — — EP disclosed
EP-0295051-A2 Preparation of oxophthalazinyl acetic acids having benzothiazole or other heterocyclic side chains PFIZER INC. (US) 1988-12-14 — — EP disclosed
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