SCHEMBL31755892

SCHEMBL31755892

CCc1cccc(-n2nnc(C(=O)Nc3ccncc3)c2C2CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
MAPT P10636 4/20 0.42
TP53 P04637 3/20 0.42
LMNA P02545 3/20 0.41
RIPK1 Q13546 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
ALOX15 P16050 1/20 0.41
POLB P06746 2/20 0.40
KDM4E B2RXH2 1/20 0.39
THRB P10828 1/20 0.39
DRD2 P14416 1/20 0.39

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
SCHEMBL31756039 0.84 CRACR2A (0.40) HTTKMT2AMAPTTP53LMNA
SCHEMBL31755653 0.82 TP53 (0.43) HTTMAPTTP53LMNASMN1; SMN2
SCHEMBL30808866 0.79 TP53 (0.55) HTTKMT2AMAPTTP53ALDH1A1
SCHEMBL31755979 0.78 MET (0.47) NR1I2KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL31755932 0.77 CRACR2A (0.41) HTTKMT2AMAPTLMNARIPK1
SCHEMBL31756155 0.75 HIF1A (0.44) HTTMAPTTP53LMNARIPK1
SCHEMBL31756327 0.74 PRKCI (0.46) NR1I2HTTKMT2AMAPTTP53
SCHEMBL31755629 0.72 CRACR2A (0.37) NR1I2KMT2AMAPTTP53LMNA
SCHEMBL31755912 0.71 MAPT (0.48) KMT2AMAPTTP53RIPK1ALDH1A1
SCHEMBL31755995 0.71 CRACR2A (0.41) HTTALDH1A1RAB9ANPC1POLB

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-20260001871-A1 TRIAZOLE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR D ESCIENT PHARMACEUTICALS INC (US) 2026-01-01 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-20260001871-A1 TRIAZOLE DERIVATIVES AS MODULATORS OF MAS-RELATED G-PROTEIN RECEPTOR D MRGPRX2, MC2R, MRGPRX1 NR1I2 352/4885HTT 2816/4885KMT2A 4128/4885

“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.