SCHEMBL31068166

SCHEMBL31068166

O=c1ccccn1Cc1ccc(Br)cn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GRM2 Q14416 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.36
MCHR1 Q99705 5/20 0.35
KLKB1 P03952 2/20 0.34
KLK1 P06870 1/20 0.34
LMNA P02545 2/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
NPC1 O15118 1/20 0.34
MITF O75030 1/20 0.34
TP53 P04637 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 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
SCHEMBL29348988 1.00 POLB (0.44) POLBNPSR1GRM2L3MBTL1MCHR1
SCHEMBL21985427 0.81 POLB (0.44) POLBNPSR1L3MBTL1KLKB1LMNA
SCHEMBL28105247 0.81 POLB (0.44) POLBNPSR1L3MBTL1KLKB1KLK1
SCHEMBL29348967 0.80 GRM2 (0.41) NPSR1GRM2MCHR1LMNAKMT2A
SCHEMBL31637527 0.80 GRM2 (0.41) NPSR1GRM2MCHR1LMNAKMT2A
SCHEMBL16880843 0.79 POLB (0.42) POLBNPSR1KLKB1KLK1
SCHEMBL29859871 0.79 POLB (0.45) POLBNPSR1L3MBTL1KLKB1KLK1
SCHEMBL16880842 0.79 POLB (0.45) POLBNPSR1L3MBTL1KLKB1KLK1
SCHEMBL29859925 0.79 KLKB1 (0.48) POLBNPSR1KLKB1KLK1
SCHEMBL27033279 0.79 KLKB1 (0.48) POLBNPSR1KLKB1KLK1

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
EP-4648853-A1 TARGETED DEGRADATION OF VAV1 Monte Rosa Therapeutics AG (CH) 2025-11-19 EP disclosed
US-20250205219-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS AG (CH) 2025-06-26 US disclosed
WO-2024151547-A1 TARGETED DEGRADATION OF VAV1 MONTE ROSA THERAPEUTICS, INC. (US) 2024-07-18 WO 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-20250205219-A1 TARGETED DEGRADATION OF VAV1 VAV1, KRAS, CBL POLB 3879/4885NPSR1 3734/4885GRM2 2101/4885

“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.