SCHEMBL11508770

SCHEMBL11508770

NCCC(=O)c1cc(N)ccc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.52
▸ KDM4E B2RXH2 7/20 0.52
▸ MAPT P10636 5/20 0.52
▸ TDP1 Q9NUW8 5/20 0.52
▸ KMT2A Q03164 4/20 0.52
▸ CYP3A4 P08684 3/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ THRB P10828 2/20 0.52
▸ RECQL P46063 2/20 0.52
▸ ALOX15 P16050 2/20 0.52
▸ MCL1 Q07820 2/20 0.52
▸ KDR P35968 2/20 0.52
▸ POLB P06746 2/20 0.52
▸ HSD17B10 Q99714 2/20 0.52
▸ USP2 O75604 1/20 0.52
▸ PKM P14618 1/20 0.52
▸ APEX1 P27695 1/20 0.52
▸ BLM P54132 1/20 0.52
▸ TNF P01375 1/20 0.52
▸ HSPD1 P10809 1/20 0.52

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
SCHEMBL11510484 0.90 KDM4E (0.49) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL11509544 0.88 ALDH1A1 (0.47) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL11509718 0.87 MAPT (0.46) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL11509832 0.85 ALDH1A1 (0.55) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL28402993 0.81 ALDH1A1 (0.55) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL231377 0.80 ALDH1A1 (0.68) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL29364937 0.80 ALDH1A1 (0.68) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL9562939 0.79 KMT2A (0.45) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL11320754 0.79 HTT (0.51) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL11509546 0.79 ALDH1A1 (0.45) ALDH1A1KDM4EMAPTTDP1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4147802-A TREATMENT WITH AMINOCARBONYL SUBSTITUTED PARAAMINOBENZOIC ACID STANLEY DRUG PRODUCTS, INC. (US) 1979-04-03 — — US claimed
US-4147802-A TREATMENT WITH AMINOCARBONYL SUBSTITUTED PARAAMINOBENZOIC ACID STANLEY DRUG PRODUCTS, INC. (US) 1979-04-03 — — US disclosed
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