SCHEMBL2494766

SCHEMBL2494766

COc1ccc(S(=O)(=O)Cl)c(OC)c1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 1/20 0.55
MAPT P10636 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 4/20 0.41
POLB P06746 3/20 0.41
KMT2A Q03164 1/20 0.41
RAB9A P51151 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
S1PR4 O95977 1/20 0.39
HSP90AA1 P07900 1/20 0.39
G6PD P11413 1/20 0.39
S1PR1 P21453 1/20 0.39
OPRK1 P41145 1/20 0.39
HTT P42858 1/20 0.39
CACNA1B Q00975 1/20 0.39
APBA1 Q02410 1/20 0.39

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
SCHEMBL29785793 1.00 TRPV4 (0.55) TRPV4MAPTTDP1ALDH1A1POLB
SCHEMBL2495168 0.85 TRPV4 (0.45) TRPV4MAPTALDH1A1POLBKMT2A
SCHEMBL8187498 0.85 TRPV4 (0.51) TRPV4MAPTALDH1A1KMT2ARAB9A
SCHEMBL6176193 0.83 TRPV4 (0.50) TRPV4MAPTTDP1ALDH1A1POLB
SCHEMBL1713241 0.82 TRPV4 (0.49) TRPV4RAB9ASMN1; SMN2NPC1NPSR1
SCHEMBL29969255 0.82 TRPV4 (0.49) TRPV4RAB9ASMN1; SMN2NPC1NPSR1
SCHEMBL11565779 0.82 ALDH1A1 (0.44) TRPV4ALDH1A1POLBKMT2ASMN1; SMN2
SCHEMBL4207227 0.80 CA2 (0.49) MAPTTDP1ALDH1A1POLBKMT2A
SCHEMBL3746673 0.80 ALDH1A1 (0.56) TRPV4MAPTALDH1A1KMT2ARAB9A
SCHEMBL7269471 0.80 MAPT (0.46) TRPV4MAPTTDP1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111943889-B Bis-aryl amine compound and preparation method and application thereof 中国医学科学院医药生物技术研究所 2022-07-22 CN disclosed
CN-111943889-A Bis-aryl amine compound and preparation method and application thereof 中国医学科学院医药生物技术研究所 2020-11-17 CN disclosed
US-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2008-12-25 US disclosed
US-6583161-B1 Regulating low-density lipoprotein (LDL) receptor expression and inhibiting abnormal cell proliferation TULARIK INC. 2003-06-24 US disclosed
US-6191170-B1 ANTICHOLESTEROL AGENTS; SKIN DISORDERS; ANTICANCER AGENTS TULARIK INC. 2001-02-20 US disclosed
WO-1999036391-A1 BENZENESULFONAMIDES AND BENZAMIDES AS THERAPEUTIC AGENTS TULARIK INC. (US) 1999-07-22 WO disclosed
EP-0167245-B1 ANTI-ARRHYTHMIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1987-06-16 EP disclosed
US-4587360-A Anti-arrhythmic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1986-05-06 US disclosed
EP-0167245-A1 Anti-arrhythmic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1986-01-08 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080318923-A1 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle AVPR1B, AVPR1A, AVPR2 TRPV4 355/4885MAPT 672/4885TDP1 1420/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.