SCHEMBL30948306

SCHEMBL30948306

ClCc1ccc(-c2ccccn2)nn1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.67
RAB9A P51151 8/20 0.67
NPC1 O15118 8/20 0.67
SMN1; SMN2 Q16637 7/20 0.67
HTT P42858 5/20 0.67
LMNA P02545 4/20 0.67
TP53 P04637 4/20 0.67
ALOX15 P16050 2/20 0.67
L3MBTL1 Q9Y468 2/20 0.67
ALDH1A1 P00352 1/20 0.67
PKM P14618 1/20 0.67
HPGD P15428 1/20 0.67
HSD17B10 Q99714 1/20 0.67
CCR1 P32246 3/20 0.52
CCR5 P51681 3/20 0.52
CCR8 P51685 3/20 0.52
POLB P06746 2/20 0.52
CYP1A2 P05177 1/20 0.52
METAP1 P53582 1/20 0.52
BLM P54132 1/20 0.52

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
SCHEMBL13734369 1.00 KDM4E (0.67) KDM4ERAB9ANPC1SMN1; SMN2HTT
SCHEMBL30211369 0.82 KDM4E (1.00) KDM4ERAB9ANPC1SMN1; SMN2HTT
SCHEMBL1456153 0.82 KDM4E (1.00) KDM4ERAB9ANPC1SMN1; SMN2HTT
SCHEMBL1456985 0.82 KDM4E (1.00) KDM4ERAB9ANPC1SMN1; SMN2HTT
SCHEMBL4181725 0.80 KDM4E (0.86) KDM4ERAB9ANPC1SMN1; SMN2HTT
SCHEMBL4174742 0.80 KDM4E (0.95) KDM4ERAB9ANPC1SMN1; SMN2HTT
SCHEMBL4189211 0.80 KDM4E (0.95) KDM4ERAB9ANPC1SMN1; SMN2HTT
SCHEMBL4178522 0.80 KDM4E (0.95) KDM4ERAB9ANPC1SMN1; SMN2HTT
SCHEMBL16715990 0.76 KDM4E (0.58) KDM4ERAB9ANPC1SMN1; SMN2HTT
SCHEMBL2720567 0.76 KDM4E (0.63) KDM4ERAB9ANPC1SMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE MERCK SHARP & DOHME LLC (US) 2024-07-25 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 (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-20240246937-A1 IL4I1 INHIBITORS AND METHODS OF USE IL4I1, IL4, IL2 KDM4E 1134/4885RAB9A 3769/4885NPC1 2807/4885

“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.