SCHEMBL6607387

SCHEMBL6607387

Oc1ccc[c]c1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
HPGD P15428 5/20 0.46
KDM4E B2RXH2 5/20 0.46
MAPT P10636 4/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
HSD17B10 Q99714 3/20 0.46
LMNA P02545 3/20 0.46
RAB9A P51151 2/20 0.46
CA12 O43570 2/20 0.46
CA2 P00918 2/20 0.46
ALOX15 P16050 2/20 0.46
CA4 P22748 2/20 0.46
CA14 Q9ULX7 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
POLB P06746 2/20 0.46
NPC1 O15118 1/20 0.46
GMNN O75496 1/20 0.46
EGFR P00533 1/20 0.46
FYN P06241 1/20 0.46
CA3 P07451 1/20 0.46

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
SCHEMBL9987990 0.84 ESR1 (0.42) ALDH1A1HPGDKDM4EMAPTSMN1; SMN2
SCHEMBL16720201 0.81 ALOX5 (0.45) ALDH1A1HPGDKDM4EMAPTSMN1; SMN2
SCHEMBL9650164 0.81 NPC1 (0.35) ALDH1A1HPGDKDM4EMAPTSMN1; SMN2
SCHEMBL9988099 0.81 TRPA1 (0.37) ALDH1A1HPGDKDM4EMAPTSMN1; SMN2
SCHEMBL16720178 0.81 QDPR (0.44) ALDH1A1HPGDKDM4EMAPTSMN1; SMN2
SCHEMBL16720069 0.81 EGFR (0.43) KDM4EMAPTHSD17B10LMNARAB9A
SCHEMBL9987901 0.79 HSD17B1 (0.48) ALDH1A1HSD17B10LMNACA12CA2
SCHEMBL16720369 0.78 MKNK1 (0.37) ALDH1A1HPGDKDM4EMAPTSMN1; SMN2
SCHEMBL2373478 0.77 SMN1; SMN2 (0.46) ALDH1A1HPGDKDM4EMAPTSMN1; SMN2
SCHEMBL16720402 0.77 KMO (0.51) ALDH1A1KDM4EMAPTLMNACA12

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
US-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-30 US claimed
EP-1423386-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-02 EP claimed
WO-2003022842-A1 THIOPHENYLTHIOPYRANE DIOXIDES AS MMP OR TNF-ALPHA INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-03-20 WO claimed
US-5160504-A Colorfastness to rubbing and light, metal-tanned leather ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1992-11-03 US claimed
US-5095100-A Metal complex dyes and preparation thereof ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 1992-03-10 US claimed
EP-3068758-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE The Wistar Institute Of Anatomy And Biology (US) 2016-09-21 EP disclosed
WO-2015073864-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2015-05-21 WO disclosed
US-6030975-A ANTAGONIST OF ENDOTHELINS, I.E. INHIBITION OF BINDING WITH RECEPTOR; ANTITUMOR AND -CARCINOGENIC AGENTS; SIDE EFFECT REDUCTION BASF AKTIENGESELLSCHAFT (DE) 2000-02-29 US disclosed
US-5969134-A CARDIOVASCULAR DISORDERS, VASOCONSTRICTION, HYPOTENSIVE AGENTS AND RELEASE OF ENDOTHELINS BASF AKTIENGESELLSCHAFT (DE) 1999-10-19 US disclosed
US-5932730-A Carboxylic acid derivatives, their preparation and use BASF AKTIENGESELLSCHAFT (DE) 1999-08-03 US 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-20040266826-A1 Thiophenylthiopyrane dioxides as mmp or tnf-alpha inhibitors TNF, MMP9, MMP1 ALDH1A1 440/4885HPGD 163/4885KDM4E 2400/4885

“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.