SCHEMBL4313800

SCHEMBL4313800

O=S(=O)(O)c1cccc(CCl)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.52
ALDH1A1 P00352 3/20 0.52
HSD17B10 Q99714 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.46
HTR6 P50406 1/20 0.40
NPC1 O15118 1/20 0.39
TNF P01375 1/20 0.39
RAB9A P51151 1/20 0.39
NOD1 Q9Y239 1/20 0.39
NAPRT Q6XQN6 1/20 0.38
FBP1 P09467 6/20 0.38
KDM4E B2RXH2 1/20 0.38
PGR P06401 1/20 0.36
PTPN11 Q06124 1/20 0.36
CASR P41180 1/20 0.36

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
Hydrochloric Acid SCHEMBL27785689 0.98 TSHR (0.50) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL21726593 0.83 TSHR (0.55) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL11413912 0.82 TSHR (0.53) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL10586812 0.82 TSHR (0.53) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL1598016 0.82 ALDH1A1 (0.48) TSHRALDH1A1HSD17B10TDP1HTR6
SCHEMBL24199108 0.80 ALDH1A1 (0.52) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL331655 0.80 TSHR (0.52) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL22124430 0.80 ALDH1A1 (0.52) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL6546793 0.80 ALDH1A1 (0.52) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2
SCHEMBL11230595 0.80 TSHR (0.52) TSHRALDH1A1HSD17B10TDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108404644-A A kind of formaldehyde trapping agent and its methods for making and using same 福建工程学院 2018-08-17 CN claimed
EP-4626548-A1 NON PEPTIDERGIC AGONISTS OF OXYTOCIN RECEPTOR Université de Strasbourg (FR) 2025-10-08 EP disclosed
WO-2024115667-A1 NON PEPTIDERGIC AGONISTS OF OXYTOCIN RECEPTOR UNIVERSITE DE STRASBOURG (FR) 2024-06-06 WO disclosed
CN-108404644-A A kind of formaldehyde trapping agent and its methods for making and using same 福建工程学院 2018-08-17 CN disclosed
CN-106947221-A Conductive polymer composition, cladding product and pattern formation method 信越化学工业株式会社 2017-07-14 CN disclosed
WO-2009134637-A1 PIPERAZINE-BASED CCR5 ANTAGONIST TABLET DOSAGE FORM SCHERING CORPORATION (US) 2009-11-05 WO disclosed