SCHEMBL1254412

SCHEMBL1254412

O=C(Cl)c1sc2cc3c(Cl)c(C(=O)Cl)sc3cc2c1Cl

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.51
BCL2L1 Q07817 1/20 0.51
RXFP1 Q9HBX9 2/20 0.50
BCKDK O14874 2/20 0.50
PPARG P37231 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
PRNP P04156 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
MAPK10 P53779 1/20 0.47
NCOA2 Q15596 1/20 0.47
RAB9A P51151 5/20 0.44
MAPT P10636 4/20 0.44
NPC1 O15118 4/20 0.44
LMNA P02545 2/20 0.44
GAA P10253 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 2/20 0.44
STING1 Q86WV6 1/20 0.44

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
SCHEMBL3063440 0.87 BCKDK (0.49) MCL1BCL2L1RXFP1BCKDKPPARG
SCHEMBL5023231 0.84 MCL1 (0.77) MCL1BCL2L1RXFP1BCKDKPPARG
SCHEMBL1609773 0.84 STING1 (0.65) MCL1BCL2L1RXFP1BCKDKPPARG
SCHEMBL2723054 0.83 BCKDK (0.75) MCL1BCL2L1RXFP1BCKDKPPARG
SCHEMBL8877598 0.83 MCL1 (0.56) MCL1BCL2L1RXFP1BCKDKPPARG
SCHEMBL6840242 0.82 MCL1 (0.45) MCL1BCL2L1RXFP1BCKDKPPARG
SCHEMBL3753518 0.81 RAB9A (0.50) MCL1BCL2L1RXFP1BCKDKPPARG
SCHEMBL3102501 0.81 RXFP1 (0.76) MCL1BCL2L1RXFP1BCKDKPPARG
SCHEMBL1255148 0.80 BCKDK (0.58) MCL1BCL2L1RXFP1BCKDKTSHR
SCHEMBL2279755 0.80 BCKDK (0.77) MCL1BCL2L1RXFP1BCKDKPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110040069-A1 CONDENSED POLYCYCLIC COMPOUND, CONDENSED POLYCYCLIC POLYMER AND ORGANIC THIN FILM CONTAINING THE COMPOUND OR THE POLYMER OSAKA UNIVERSITY (JP) 2011-02-17 US disclosed
EP-2248840-A1 CONDENSED POLYCYCLIC COMPOUND, CONDENSED POLYCYCLIC POLYMER AND ORGANIC THIN FILM CONTAINING THE COMPOUND OR THE POLYMER Osaka University (JP) 2010-11-10 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-20110040069-A1 CONDENSED POLYCYCLIC COMPOUND, CONDENSED POLYCYCLIC POLYMER AND ORGANIC THIN FILM CONTAINING THE COMPOUND OR THE POLYMER SLC43A1, SLC7A5, SLCO2A1 MCL1 3334/4885BCL2L1 2738/4885RXFP1 3565/4885

“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.