SCHEMBL20179628

SCHEMBL20179628

C=C(CC)c1ccc(F)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
NPC1 O15118 3/20 0.39
RAB9A P51151 2/20 0.39
P2RX7 Q99572 1/20 0.38
PYGL P06737 5/20 0.36
CTSL P07711 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
ALOX15 P16050 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
HSD11B1 P28845 1/20 0.35

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
SCHEMBL8091206 0.81 POLB (0.49) HPGDALDH1A1LMNAALOX15MAPK1
SCHEMBL3340113 0.81 CES2 (0.50) ALDH1A1PKM
SCHEMBL9423079 0.78 HPGD (0.49) HPGDNPC1RAB9AP2RX7PYGL
SCHEMBL5286155 0.75 NPC1 (0.42) NPC1RAB9ACTSLALDH1A1LMNA
SCHEMBL22366247 0.75 IDO1 (0.40) P2RX7SLC6A2SLC6A4KMT2A
SCHEMBL26669721 0.75 TSHR (0.35) HPGDLMNA
SCHEMBL6071851 0.74 HPGD (0.47) HPGDNPC1RAB9AP2RX7PYGL
Ethylene SCHEMBL10650663 0.73 HPGD (0.44) HPGDNPC1RAB9AP2RX7PYGL
SCHEMBL8444340 0.72 CES2 (0.46) HPGDALDH1A1LMNAKMT2A
SCHEMBL8967743 0.71 HPGD (0.46) HPGDNPC1RAB9AP2RX7PYGL

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-3434668-B1 INDOLO-SUBSTITUTED-PIPERIDINE COMPOUNDS AS ESTROGEN RECEPTOR DEGRADING AGENT LUOXIN PHARMACEUTICAL SHANGHAI CO LTD (CN) 2020-08-26 EP disclosed
EP-3434668-A1 INDOLO-SUBSTITUTED-PIPERIDINE COMPOUNDS AS ESTROGEN RECEPTOR DEGRADING AGENT Luoxin Biotechnology (Shanghai) Co., Ltd. (CN) 2019-01-30 EP disclosed
WO-2018091153-A1 NOVEL SUBSTITUTED N-(3-FLUOROPROPYL)-PYRROLIDINE COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI (FR) 2018-05-24 WO disclosed