SCHEMBL19731335

SCHEMBL19731335

COC(=O)c1c(Cl)cccc1CI

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
POLB P06746 3/20 0.44
NR4A2 P43354 3/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 2/20 0.43
ALDH1A1 P00352 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
FEN1 P39748 1/20 0.41
PDE3B Q13370 1/20 0.40

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
SCHEMBL5256415 0.88 LMNA (0.50) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL5256419 0.85 LMNA (0.50) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL4996201 0.85 LMNA (0.50) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL484670 0.83 LMNA (0.49) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL19879735 0.83 LMNA (0.49) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL30296784 0.82 LMNA (0.48) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL26712747 0.82 LMNA (0.48) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL517538 0.82 CA12 (0.61) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL6067950 0.81 CA12 (0.48) LMNASMN1; SMN2CA12CA1CA2
SCHEMBL14022034 0.81 ALDH1A1 (0.45) LMNASMN1; SMN2ALDH1A1NPC1RAB9A

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-10471051-B2 Heterocyclic inhibitors of ERK1 and ERK2 and their use in the treatment of cancer ASANA BIOSCIENCES, LLC (US) 2019-11-12 US disclosed
US-20170362216-A1 HETEROCYCLIC INHIBITORS OF ERK1 AND ERK2 AND THEIR USE IN THE TREATEMENT OF CANCER ASANA BIOSCIENCES, LLC 2017-12-21 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-20170362216-A1 HETEROCYCLIC INHIBITORS OF ERK1 AND ERK2 AND THEIR USE IN THE TREATEMENT OF CANCER KRAS, NRAS, RAF1 LMNA 3548/4885SMN1; SMN2 1340/4885CA12 4596/4885
US-10471051-B2 Heterocyclic inhibitors of ERK1 and ERK2 and their use in the treatment of cancer KRAS, NRAS, RAF1 LMNA 3393/4885SMN1; SMN2 1201/4885CA12 4256/4885

“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.