SCHEMBL2031182

SCHEMBL2031182

O=C(CCl)Nc1c[c]ccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.50
HTT P42858 9/20 0.50
SMN1; SMN2 Q16637 7/20 0.50
MITF O75030 5/20 0.50
RAB9A P51151 4/20 0.50
NPC1 O15118 3/20 0.50
NOD2 Q9HC29 2/20 0.47
NPSR1 Q6W5P4 2/20 0.47
XBP1 P17861 1/20 0.47
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.46
LMNA P02545 6/20 0.46
MAPT P10636 5/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 2/20 0.46
MEN1 O00255 2/20 0.46
RNF4 P78317 1/20 0.46
PRMT1 Q99873 1/20 0.46
CASP3 P42574 1/20 0.43
CASP2 P42575 1/20 0.43

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
SCHEMBL1418819 0.84 SCN1A (0.40) HTTSMN1; SMN2RAB9APOLBMAPT
SCHEMBL9434890 0.82 HDAC1 (0.46) KMT2AKDM4EMEN1HDAC3HDAC4
SCHEMBL25438215 0.82 HDAC3 (0.42) HTTSMN1; SMN2MAPTKMT2AMEN1
SCHEMBL6973545 0.82 MEN1 (0.49) POLBMAPTKMT2AMEN1HDAC3
SCHEMBL359542 0.82 GAA (0.54) ALDH1A1SMN1; SMN2RAB9ANPC1POLB
SCHEMBL3111441 0.82 CA1 (0.51) MAPTHDAC3HDAC4HDAC1HDAC7
SCHEMBL3108447 0.81 TERT (0.47) ALDH1A1HTTMAPTKMT2AKDM4E
SCHEMBL1419036 0.81 MAPT (0.42) ALDH1A1HTTSMN1; SMN2MAPTKDM4E
SCHEMBL1418810 0.79 ALDH1A1 (0.57) ALDH1A1HTTSMN1; SMN2RAB9ANPC1
SCHEMBL3333827 0.79 L3MBTL1 (0.60) ALDH1A1HTTSMN1; SMN2POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2388003-B1 Colchicine derivatives CALIFORNIA PACIFIC MEDICAL CENTER (US) 2021-12-29 EP claimed
EP-2388003-A2 Colchicine derivatives California Pacific Medical Center (US) 2011-11-23 EP claimed
JP-4699373-B2 2011-06-08 JP claimed
EP-1617843-A2 COLCHICINE DERIVATIVES California Pacific Medical Center (US) 2006-01-25 EP claimed
WO-2005007076-A2 COLCHICINE DERIVATIVES CALIFORNIA PACIFIC MEDICAL CENTER (US) 2005-01-27 WO claimed
US-6825236-B2 ACTIVE AGAINST TUMORS IN MICE AND ARE GENERALLY WELL TOLERATED CALIFORNIA PACIFIC MEDICAL CENTER 2004-11-30 US claimed
US-20040204370-A1 COLCHICINE DERIVATIVES SUTTER WEST BAY HOSPITALS, DBA CALIFORNIA PACIFIC MEDICAL CENTER 2004-10-14 US claimed
EP-2388003-B1 Colchicine derivatives CALIFORNIA PACIFIC MEDICAL CENTER (US) 2021-12-29 EP disclosed
EP-3207929-A2 COLCHICINE DERIVATIVES California Pacific Medical Center (US) 2017-08-23 EP disclosed
EP-1617843-B1 COLCHICINE DERIVATIVES CALIFORNIA PACIFIC MEDICAL CENTER (US) 2016-12-21 EP disclosed
EP-2388003-A2 Colchicine derivatives California Pacific Medical Center (US) 2011-11-23 EP disclosed
EP-1617843-A2 COLCHICINE DERIVATIVES California Pacific Medical Center (US) 2006-01-25 EP disclosed
WO-2005007076-A2 COLCHICINE DERIVATIVES CALIFORNIA PACIFIC MEDICAL CENTER (US) 2005-01-27 WO disclosed
US-6825236-B2 ACTIVE AGAINST TUMORS IN MICE AND ARE GENERALLY WELL TOLERATED CALIFORNIA PACIFIC MEDICAL CENTER 2004-11-30 US disclosed
US-20040204370-A1 COLCHICINE DERIVATIVES SUTTER WEST BAY HOSPITALS, DBA CALIFORNIA PACIFIC MEDICAL CENTER 2004-10-14 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-20040204370-A1 COLCHICINE DERIVATIVES H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCCS, NAP1L4 ALDH1A1 2730/4885HTT 842/4885SMN1; SMN2 1941/4885

“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.