SCHEMBL10433744

SCHEMBL10433744

O=S(=O)(O)[C]c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPC1 O15118 1/20 0.43
MTOR P42345 1/20 0.43
RAB9A P51151 1/20 0.43
APP P05067 1/20 0.41
CA2 P00918 6/20 0.40
CA1 P00915 5/20 0.40
CA12 O43570 4/20 0.40
CA9 Q16790 4/20 0.40
HTR6 P50406 1/20 0.38
MMP1 P03956 2/20 0.37
MMP2 P08253 2/20 0.37
MMP9 P14780 2/20 0.37
MMP8 P22894 2/20 0.37
MMP13 P45452 2/20 0.37
SRC P12931 1/20 0.37
ALDH1A1 P00352 2/20 0.35
POLB P06746 1/20 0.35
CYP2D6 P10635 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
SCHEMBL27891812 0.75 NPC1 (0.61) TSHRSMN1; SMN2NPC1MTORRAB9A
SCHEMBL8004019 0.74 NPC1 (0.48) TSHRSMN1; SMN2NPC1MTORRAB9A
Benzonitrile SCHEMBL7635221 0.72 TSHR (0.70) TSHRSMN1; SMN2NPC1MTORRAB9A
Benzonitrile SCHEMBL12469615 0.72 TSHR (0.70) TSHRSMN1; SMN2NPC1MTORRAB9A
Benzonitrile SCHEMBL28806619 0.72 TSHR (0.70) TSHRSMN1; SMN2NPC1MTORRAB9A
Diphenylacetylene SCHEMBL27721387 0.72 APP (0.60) TSHRSMN1; SMN2NPC1MTORRAB9A
SCHEMBL10698477 0.72 HTR6 (0.48) TSHRSMN1; SMN2NPC1MTORRAB9A
SCHEMBL10675096 0.70 NPC1 (0.45) TSHRNPC1MTORRAB9AAPP
SCHEMBL10680617 0.69 NPC1 (0.43) TSHRSMN1; SMN2NPC1MTORRAB9A
SCHEMBL5791201 0.69 TSHR (0.41) TSHRSMN1; SMN2NPC1MTORRAB9A

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-0373339-A1 Silver halide recording material Agfa-Gevaert AG (DE) 1990-06-20 EP claimed
US-4124592-A INDICATOR DYES POLAROID CORPORATION (US) 1978-11-07 US disclosed
US-4021241-A Diffusion transfer processing solutions with carboxymethyl hydroxyethyl cellulose POLAROID CORPORATION (US) 1977-05-03 US disclosed