SCHEMBL11509544

SCHEMBL11509544

NCCCCC(=O)c1cc(N)ccc1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.47
▸ TDP1 Q9NUW8 6/20 0.47
▸ MAPT P10636 5/20 0.47
▸ KDM4E B2RXH2 5/20 0.47
▸ MEN1 O00255 4/20 0.47
▸ KMT2A Q03164 4/20 0.47
▸ THRB P10828 3/20 0.47
▸ RECQL P46063 3/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ BLM P54132 2/20 0.47
▸ ALOX15 P16050 2/20 0.47
▸ POLB P06746 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ APEX1 P27695 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ TNF P01375 1/20 0.47
▸ HSPD1 P10809 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ HPGD P15428 1/20 0.47

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
SCHEMBL11509718 0.98 MAPT (0.46) ALDH1A1TDP1MAPTKDM4EMEN1
SCHEMBL11510484 0.95 KDM4E (0.49) ALDH1A1TDP1MAPTKDM4EMEN1
SCHEMBL11508770 0.88 ALDH1A1 (0.52) ALDH1A1TDP1MAPTKDM4EMEN1
SCHEMBL11320754 0.84 HTT (0.51) ALDH1A1TDP1MAPTKDM4EMEN1
SCHEMBL11509832 0.81 ALDH1A1 (0.55) ALDH1A1TDP1MAPTKDM4EMEN1
SCHEMBL10788480 0.80 ALDH1A1 (0.52) ALDH1A1TDP1MAPTKDM4EMEN1
SCHEMBL11509720 0.79 ALDH1A1 (0.42) ALDH1A1TDP1MAPTKDM4EMEN1
SCHEMBL28402993 0.78 ALDH1A1 (0.55) ALDH1A1TDP1MAPTKDM4EMEN1
SCHEMBL18428523 0.77 GSR (0.46) ALDH1A1TDP1MAPTKDM4EMEN1
SCHEMBL18428522 0.77 GSR (0.46) ALDH1A1TDP1MAPTKDM4EMEN1

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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