SCHEMBL29851236

SCHEMBL29851236

O=C(O)Nc1cccc2cccnc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 3/20 0.71
▸ MEN1 O00255 3/20 0.69
▸ KMT2A Q03164 3/20 0.69
▸ SMN1; SMN2 Q16637 3/20 0.69
▸ MAPT P10636 2/20 0.69
▸ TDP1 Q9NUW8 3/20 0.69
▸ POLB P06746 2/20 0.69
▸ KDM4E B2RXH2 2/20 0.68
▸ RECQL P46063 1/20 0.68
▸ HTT P42858 3/20 0.64
▸ CASP3 P42574 2/20 0.63
▸ SENP8 Q96LD8 2/20 0.63
▸ SENP7 Q9BQF6 2/20 0.63
▸ HDAC6 Q9UBN7 1/20 0.63
▸ CYP1A2 P05177 1/20 0.63
▸ CYP3A4 P08684 1/20 0.63
▸ NPC1 O15118 3/20 0.62
▸ RAB9A P51151 3/20 0.62
▸ GAA P10253 1/20 0.61
▸ L3MBTL1 Q9Y468 1/20 0.61

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
SCHEMBL1695444 1.00 KDR (0.71) KDRMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL10994584 0.85 KDR (0.58) KDRMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL29903003 0.85 HSP90AA1 (0.57) KDRMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL1753903 0.84 TDP1 (0.79) KDRMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL14851783 0.84 TDP1 (0.69) KDRMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL27599095 0.84 TDP1 (0.67) KDRMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL3909349 0.84 TDP1 (0.67) KDRMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL3549883 0.84 CYP1A2 (0.71) KDRMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL29918706 0.84 TDP1 (0.71) KDRMEN1KMT2ASMN1; SMN2MAPT
SCHEMBL5053488 0.84 TDP1 (0.71) KDRMEN1KMT2ASMN1; SMN2MAPT

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
EP-3914256-B1 GPR35 MODULATORS PROMETHEUS BIOSCIENCES INC (US) 2024-05-29 — — EP disclosed
US-11773101-B2 GPR35 modulators PROMETHEUS BIOSCIENCES, INC. (US) 2023-10-03 — — 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-11773101-B2 GPR35 modulators GPR35, GPR55, GPR65 KDR 1382/4885MEN1 3744/4885KMT2A 4331/4885

“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.

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