SCHEMBL8760668

SCHEMBL8760668

C[C](C)c1ccc(Cl)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
TSHR P16473 2/20 0.58
CASP1 P29466 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
GABRA1 P14867 6/20 0.57
GABRG2 P18507 6/20 0.57
GABRB3 P28472 6/20 0.57
GABRB2 P47870 4/20 0.57
GABRB1 P18505 2/20 0.57
ALDH1A1 P00352 3/20 0.52
MAPK1 P28482 1/20 0.52
HIF1A Q16665 1/20 0.52
MAPT P10636 3/20 0.50
KDM4E B2RXH2 1/20 0.50
HSD17B10 Q99714 1/20 0.48
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.47
THRB P10828 1/20 0.47
RECQL P46063 1/20 0.47

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
SCHEMBL21994599 0.81 MEN1 (0.59) MEN1KMT2ATSHRCASP1SMN1; SMN2
SCHEMBL13412590 0.81 GABRA1 (0.63) MEN1KMT2ATSHRCASP1SMN1; SMN2
SCHEMBL322161 0.81 TSHR (0.65) MEN1KMT2ATSHRCASP1SMN1; SMN2
SCHEMBL13689698 0.81 MEN1 (0.59) MEN1KMT2ATSHRCASP1SMN1; SMN2
SCHEMBL29384783 0.81 TSHR (0.65) MEN1KMT2ATSHRCASP1SMN1; SMN2
SCHEMBL16954077 0.80 ALDH1A1 (0.58) MEN1KMT2ATSHRSMN1; SMN2GABRA1
SCHEMBL12224079 0.79 GABRA1 (0.65) MEN1KMT2ATSHRCASP1SMN1; SMN2
SCHEMBL12820003 0.79 GABRA1 (0.65) MEN1KMT2ATSHRCASP1SMN1; SMN2
SCHEMBL432702 0.78 MEN1 (0.55) MEN1KMT2ATSHRCASP1SMN1; SMN2
SCHEMBL9590622 0.78 MEN1 (0.55) MEN1KMT2ATSHRCASP1SMN1; 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-22 US disclosed
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2016-11-24 US disclosed
EP-0635485-B1 TETRAHYDROPHTHALAMIDE DERIVATIVE, INTERMEDIATE FOR PRODUCING THE SAME, PRODUCTION OF BOTH, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEM RES (JP) 1997-06-11 EP disclosed
US-5554581-A Tetrahydrophthalamide derivative, intermediate for producing the same, production of both, and herbicide containing the same as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-09-10 US disclosed
US-5506190-A Tetrahydrophthalamide derivative, intermediate for producing the same, production of both, and herbicide containing the same as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-04-09 US disclosed
EP-0635485-A1 TETRAHYDROPHTHALAMIDE DERIVATIVE, INTERMEDIATE FOR PRODUCING THE SAME, PRODUCTION OF BOTH, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEMICAL RESEARCH CENTER (JP) 1995-01-25 EP disclosed
US-5194441-A Fungicides BASF AKTIENGESELLSCHAFT (DE) 1993-03-16 US disclosed
US-5081139-A N-SUBSTITUTED TRIAZOLE DERIVATIVES AND FUNGICIDAL USE THEREOF SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1992-01-14 US disclosed
EP-0174271-B1 ANTHRACEME DERIVATIVES CIBA-GEIGY AG (CH) 1991-10-16 EP disclosed
EP-0174271-A2 Anthraceme derivatives CIBA-GEIGY AG (CH) 1986-03-12 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 (2 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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical CBR1, HAO2, CBR3 MEN1 4766/4885KMT2A 3389/4885TSHR 648/4885
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL CBR1, HAO2, CBR3 MEN1 4766/4885KMT2A 3389/4885TSHR 648/4885

“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.