SCHEMBL31529370

SCHEMBL31529370

COc1cc(-c2ccccn2)nc2ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.67
▸ LMNA P02545 2/20 0.67
▸ HPGD P15428 2/20 0.67
▸ KDM4E B2RXH2 5/20 0.60
▸ ALDH1A1 P00352 3/20 0.60
▸ MAPT P10636 2/20 0.60
▸ HTT P42858 1/20 0.60
▸ METAP1 P53582 4/20 0.54
▸ CYP3A4 P08684 2/20 0.53
▸ ABCB1 P08183 1/20 0.52
▸ ABCG2 Q9UNQ0 1/20 0.52
▸ ALOX15 P16050 1/20 0.51
▸ RXFP1 Q9HBX9 1/20 0.50
▸ SYK P43405 1/20 0.50
▸ NPC1 O15118 1/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ MEN1 O00255 1/20 0.49

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
SCHEMBL8352678 0.85 SMN1; SMN2 (0.68) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL955714 0.80 SMN1; SMN2 (1.00) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL15692161 0.79 MAPK1 (0.56) LMNAKDM4EMETAP1CYP3A4RXFP1
SCHEMBL25522278 0.79 ACACA (0.72) LMNAHPGDKDM4EALDH1A1MAPT
SCHEMBL8140217 0.77 ADORA2A (0.50) SMN1; SMN2LMNAHPGDKDM4EALDH1A1
SCHEMBL13243235 0.76 CYP3A4 (0.53) KDM4EALDH1A1MAPTMETAP1CYP3A4
SCHEMBL25416501 0.76 KDM4E (0.61) LMNAKDM4EMETAP1CYP3A4RXFP1
SCHEMBL30368831 0.76 ACHE (0.64) LMNAKDM4EMETAP1CYP3A4RXFP1
SCHEMBL10610977 0.76 KDM4E (0.57) SMN1; SMN2LMNAKDM4EALDH1A1METAP1
SCHEMBL2712210 0.76 ACHE (0.64) LMNAKDM4EMETAP1CYP3A4RXFP1

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-20250145599-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS MRJA THERAPEUTICS, INC. 2025-05-08 — — 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-20250145599-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS IGF1R, IGFBP1, IGFBP2 SMN1; SMN2 1317/4885LMNA 978/4885HPGD 1604/4885

“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.

Send feedback