SCHEMBL19677948

SCHEMBL19677948

CCc1ncn2cccnc12

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 2/20 0.33
SMPD3 Q9NY59 2/20 0.33
AXL P30530 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
GABRA5 P31644 1/20 0.31
PIK3CG P48736 1/20 0.31
KDM4D Q6B0I6 1/20 0.30
PDE5A O76074 1/20 0.30

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
SCHEMBL6860396 0.78 PIK3CG (0.41) KDM4EALDH1A1HPGDSMPD3AXL
SCHEMBL19520117 0.75 NUDT1 (0.46) ALDH1A1
SCHEMBL24983903 0.72 PIK3CG (0.35) KDM4EALDH1A1HPGDPIK3CG
SCHEMBL5496407 0.69 NUDT1 (0.56) KDM4EALDH1A1HPGDSMPD3AXL
SCHEMBL26354530 0.69 PIK3CG (0.33) PIK3CGPDE5A
SCHEMBL20348407 0.69 ALDH1A1 (0.38) KDM4EALDH1A1HPGDSMPD3SMN1; SMN2
SCHEMBL21937448 0.69 PIK3CG (0.45) SMPD3AXLPIK3CG
SCHEMBL11155397 0.69 DRD4 (0.40) KDM4EALDH1A1HPGDSMN1; SMN2GABRA5
SCHEMBL13377380 0.68 KDM4E (0.33) KDM4EALDH1A1HPGDSMPD3AXL
SCHEMBL23176172 0.68 BRD4 (0.33) ALDH1A1

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
US-20200039998-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND METHODS OF USE THEREOF Epizyme, Inc. 2020-02-06 US disclosed
US-9920061-B2 Imidazo[1,5-A]pyrimidinyl carboxamide compounds and their use in the treatment of medical disorders LYSOSOMAL THERAPEUTICS INC. (US) 2018-03-20 US disclosed
US-20170349599-A1 IMIDAZO[1,5-A]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL - R&D INVESTMENTS, S.A. (PT) 2017-12-07 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-20200039998-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND METHODS OF USE THEREOF HNMT, BHMT, EHMT2 KDM4E 222/4885ALDH1A1 180/4885HPGD 204/4885
US-20170349599-A1 IMIDAZO[1,5-A]PYRIMIDINYL CARBOXAMIDE COMPOUNDS AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, GBA2 KDM4E 659/4885ALDH1A1 1121/4885HPGD 2135/4885

“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.