SCHEMBL19320611

SCHEMBL19320611

OCc1nn2cc(-c3nccs3)nc2s1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 8/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ MAPT P10636 5/20 0.40
▸ F2RL3 Q96RI0 7/20 0.38
▸ HPGD P15428 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.35
▸ PDE10A Q9Y233 2/20 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
SCHEMBL19325381 0.75 F2RL3 (0.57) F2RL3
SCHEMBL6558073 0.69 SPHK2 (0.46) RAB9AHSP90AA1
SCHEMBL218318 0.64 NR4A2 (0.36) SMN1; SMN2NPC1PKMRAB9AMAPT
SCHEMBL167744 0.61 — —
SCHEMBL4539976 0.61 RAB9A (0.49) RAB9AHSP90AA1
SCHEMBL28154527 0.60 PDPK1 (0.56) RAB9AHSP90AA1
Hydrochloric Acid SCHEMBL10781780 0.60 — —
SCHEMBL14843173 0.59 PDE10A (0.52) PDE10A
SCHEMBL102331 0.58 PDPK1 (0.59) RAB9AHSP90AA1
SCHEMBL18641363 0.58 SRC (0.38) RAB9AHSP90AA1

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
US-9963466-B2 Substituted 5-membered heterocyclic analogs as protease activated receptor 4 (PAR-4) antagonists VANDERBILT UNIVERSITY (US) 2018-05-08 — — US disclosed
US-20170253617-A1 Substituted 5-Membered Heterocyclic Analogs as Protease Activated Receptor 4 (PAR-4) Antagonists VANDERBILT UNIVERSITY 2017-09-07 — — 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 (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-20170253617-A1 Substituted 5-Membered Heterocyclic Analogs as Protease Activated Receptor 4 (PAR-4) Antagonists F2RL3, F2R, F2RL1 TP53 1679/4885SMN1; SMN2 4473/4885NPC1 2109/4885

“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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