SCHEMBL11117970

SCHEMBL11117970

C=CCc1ccc(N2CCCCCC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ CHKA P35790 7/20 0.49
▸ BCHE P06276 1/20 0.49
▸ ACHE P22303 1/20 0.49
▸ MAPT P10636 3/20 0.48
▸ ALOX15 P16050 3/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ USP2 O75604 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ KMT2A Q03164 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
SCHEMBL5134023 1.00 ALDH1A1 (0.50) ALDH1A1KDM4ESMN1; SMN2CHKABCHE
SCHEMBL27862519 0.90 ALDH1A1 (0.47) ALDH1A1KDM4ESMN1; SMN2CHKAMAPT
SCHEMBL28210915 0.84 CNR2 (0.49) ALDH1A1KDM4ESMN1; SMN2CHKAMAPT
SCHEMBL6065386 0.82 ALDH1A1 (0.62) ALDH1A1KDM4ESMN1; SMN2CHKABCHE
SCHEMBL6675490 0.81 ADRB1 (0.53) ALDH1A1KDM4EUSP2HSD17B10LMNA
SCHEMBL6675497 0.81 ADRB1 (0.53) ALDH1A1KDM4EUSP2HSD17B10LMNA
SCHEMBL27862322 0.80 PRMT6 (0.58) ALDH1A1KDM4ECHKABCHEACHE
SCHEMBL15551035 0.79 TRIM24 (0.61) ALDH1A1KDM4ESMN1; SMN2CHKABCHE
SCHEMBL9915870 0.79 CHKA (0.65) ALDH1A1KDM4ESMN1; SMN2CHKABCHE
SCHEMBL11859247 0.79 ALDH1A1 (0.57) ALDH1A1KDM4ESMN1; SMN2CHKABCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0127203-A1 New phthalide derivatives, process for preparing the same and recording system utilizing the same as colourless chromogenic material KANZAKI PAPER MANUFACTURING CO., LTD (JP) 1984-12-05 — — EP disclosed
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