SCHEMBL21175823

SCHEMBL21175823

COCCCCc1cc(Br)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.46
KDM4E B2RXH2 6/20 0.44
LMNA P02545 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SLC6A4 P31645 5/20 0.38
KCNH2 Q12809 3/20 0.38
HTR2A P28223 2/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
MC4R P32245 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL17399935 0.95 HPGD (0.47) HPGDKDM4ELMNANPC1RAB9A
SCHEMBL2811599 0.81 KDM4E (0.43) HPGDKDM4ELMNANPC1RAB9A
SCHEMBL6681997 0.81 ABL1 (0.41) HPGDLMNANPC1RAB9ASMN1; SMN2
SCHEMBL2934176 0.80 KDM4E (0.48) KDM4ELMNASMN1; SMN2KMT2AMEN1
SCHEMBL3469320 0.79 KDM4E (0.37) HPGDKDM4ELMNANPC1RAB9A
SCHEMBL2870657 0.77 HPGD (0.44) HPGDKDM4ELMNASMN1; SMN2SLC6A4
SCHEMBL30622246 0.77 HPGD (0.44) HPGDKDM4ELMNASMN1; SMN2SLC6A4
SCHEMBL2810557 0.76 KDM4E (0.41) HPGDKDM4ELMNANPC1RAB9A
SCHEMBL9503395 0.75 ALDH1A1 (0.42) HPGDLMNASMN1; SMN2SLC6A4KCNH2
SCHEMBL90673 0.75 KDM4E (0.51) HPGDKDM4ELMNANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11058678-B2 Substituted heterocycles as antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2021-07-13 US disclosed
WO-2019143902-A2 SUBSTITUTED HETEROCYCLES AS ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. (US) 2019-07-25 WO disclosed
US-20190224188-A1 SUBSTITUTED HETEROCYCLES AS ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2019-07-25 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 (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-20190224188-A1 SUBSTITUTED HETEROCYCLES AS ANTIVIRAL AGENTS HCCS, HDGF, HAVCR2 HPGD 299/4885KDM4E 1806/4885LMNA 2465/4885
US-11058678-B2 Substituted heterocycles as antiviral agents HCCS, HDGF, HAVCR2 HPGD 299/4885KDM4E 1806/4885LMNA 2465/4885

“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.