SCHEMBL7296560

SCHEMBL7296560

Oc1ccc(N2CCCC2)cc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TERT O14746 3/20 0.48
▸ ALDH1A1 P00352 6/20 0.47
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ MAPT P10636 5/20 0.47
▸ L3MBTL1 Q9Y468 5/20 0.47
▸ ALOX15 P16050 4/20 0.47
▸ GAA P10253 4/20 0.47
▸ S100B P04271 2/20 0.47
▸ HTT P42858 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ PKM P14618 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ IP6K1 Q92551 1/20 0.46
▸ HSD17B10 Q99714 4/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ SERPINE1 P05121 1/20 0.44
▸ POLB P06746 2/20 0.43

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
Bromide SCHEMBL7294983 0.98 TERT (0.47) TERTALDH1A1MEN1KMT2AMAPT
SCHEMBL10804218 0.98 ALDH1A1 (0.50) TERTALDH1A1MEN1KMT2AMAPT
SCHEMBL19381143 0.83 ALDH1A1 (0.58) TERTALDH1A1MEN1KMT2AMAPT
SCHEMBL13182828 0.81 ADRB1 (0.56) ALDH1A1HTTLMNAKDM4ETP53
SCHEMBL11791151 0.81 PRKDC (0.65) ALDH1A1MEN1KMT2AMAPTALOX15
SCHEMBL19381146 0.81 ALDH1A1 (0.61) TERTALDH1A1MEN1KMT2AMAPT
SCHEMBL19381288 0.81 ALDH1A1 (0.61) TERTALDH1A1MEN1KMT2AMAPT
SCHEMBL1599743 0.81 ALDH1A1 (0.49) TERTALDH1A1MEN1KMT2AMAPT
SCHEMBL19381286 0.81 ALDH1A1 (0.61) TERTALDH1A1MEN1KMT2AMAPT
SCHEMBL2939766 0.81 DRD2 (0.46) TERTALDH1A1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0381235-A2 Pyrrolidine compound and pharmaceutical use Eisai Co., Ltd. (JP) 1990-08-08 — — EP claimed
EP-0641320-B1 SUBSTITUTED (S)-3-PHENYLPIPERIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS DOPAMINE AUTORECEPTOR ANTAGONISTS UPJOHN CO (US) 2001-05-30 — — EP disclosed
EP-0381235-A2 Pyrrolidine compound and pharmaceutical use Eisai Co., Ltd. (JP) 1990-08-08 — — EP disclosed
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