SCHEMBL7439896

SCHEMBL7439896

O=C(O)C1(C(=O)NC2CCN(S(=O)(=O)c3ccccc3)CC2)CCCC1

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.63
KMT2A Q03164 5/20 0.62
MEN1 O00255 4/20 0.62
CYP2D6 P10635 1/20 0.59
EPHX2 P34913 2/20 0.58
POLB P06746 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 1/20 0.49
PKM P14618 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL8091601 0.77 EPHX2 (0.88) ALDH1A1KMT2AMEN1EPHX2
SCHEMBL7435943 0.77 ALDH1A1 (0.46) ALDH1A1KMT2AMEN1EPHX2POLB
SCHEMBL8092142 0.77 ALDH1A1 (0.48) ALDH1A1KMT2AMEN1EPHX2POLB
SCHEMBL7435936 0.76 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1CYP2D6EPHX2
SCHEMBL8091489 0.76 ALDH1A1 (0.45) ALDH1A1KMT2AMEN1EPHX2POLB
SCHEMBL14365707 0.76 MEN1 (0.69) ALDH1A1KMT2AMEN1EPHX2POLB
SCHEMBL7824315 0.75 CYP2D6 (1.00) ALDH1A1KMT2AMEN1CYP2D6POLB
SCHEMBL4963774 0.73 ALDH1A1 (0.54) ALDH1A1KMT2AMEN1CYP2D6EPHX2
SCHEMBL6408553 0.73 ALDH1A1 (0.54) ALDH1A1KMT2AMEN1CYP2D6EPHX2
SCHEMBL2746362 0.72 KMT2A (0.64) ALDH1A1KMT2AMEN1EPHX2POLB

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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5490946-A OIL ADDITIVES EXXON RESEARCH AND ENGINEERING COMPANY (US) 1996-02-13 US claimed
US-RE34414-E Inhibitors of animal tissue fibrosis TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-10-19 US claimed
US-5219851-A Di-, tri- and tetrapeptides as hypotensive agents and for treating glaucoma, congestive heart failure and aldosteronism as well as an agent in diagnostic tests WARNER-LAMBERT COMPANY (US) 1993-06-15 US claimed
US-4960785-A Indolinone derivatives PFIZER INC. (US) 1990-10-02 US claimed
US-4939148-A Amine derivatives, processes for their production and their use SANDOZ, LTD. (CH) 1990-07-03 US claimed
US-4921980-A REACTION OF AN ANILINE COMPOUND WITH AN ALCOHOL, SILICA GEL SUPPORTED PLATINUM CATALYST CIBA-GEIGY CORPORATION (US) 1990-05-01 US claimed
US-4918090-A ADMINISTERING TO STROKE PATIENT WARNER-LAMBERT COMPANY (US) 1990-04-17 US claimed
US-4797149-A HERBICIDES MONSANTO COMPANY (US) 1989-01-10 US claimed
US-4749790-A Process for preparing H2 receptor antagonist ascorbate compounds BARISINTEX, S.A (ES) 1988-06-07 US claimed
US-4672116-A CARDIOTONIC AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1987-06-09 US claimed
US-4628056-A Novel oxopyrimidine derivatives, pharmaceutical compositions containing them and their use as anticonvulsant, antianxiety and muscle relaxant agents TARO PHARMACEUTICAL INDUSTRIES LTD. (IL) 1986-12-09 US claimed
US-4569897-A IMIDIZED ACRYLIC POLYMERS AND CROSSLINKING AZIDE PHOTOSENSITIZER IN A SOLVENT ROHM AND HAAS COMPANY (US) 1986-02-11 US claimed
US-4524071-A HISTAMINE H2-ANTAGONISTS GLAXO GROUP LIMITED (GB) 1985-06-18 US claimed
US-4430499-A 7-[2-(2-Aminooxazol-4-yl)-2-(oximino)acetamido]cephalosporin antibiotics ELI LILLY AND COMPANY (US) 1984-02-07 US claimed
US-4273766-A Nitroso-urea derivatives CIBA-GEIGY CORPORATION (US) 1981-06-16 US claimed
US-4252530-A USING A BASE AS DISCHARGE AGENT IN A DISCHARGE RESIST PASTE AND HEATING CASSELLA AKTIENGESELLSCHAFT (DE) 1981-02-24 US claimed
US-4206232-A Relieving hypertension with carboxyalkylacylamino acids E. R. SQUIBB & SONS, INC. (US) 1980-06-03 US claimed
US-4127405-A TRIAZINYL E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-11-28 US claimed
US-4062961-A SUBSTITUTED 1,2,3,4-TETRAHYDROISOQUINOLINES SMITHKLINE CORPORATION (US) 1977-12-13 US claimed
US-4038414-A ANTIARRHYTHMIA AGENTS CIBA-GEIGY CORPORATION (US) 1977-07-26 US claimed