SCHEMBL14091277

SCHEMBL14091277

Cc1cccc2nc(-c3c[nH]nc3-c3ccccc3)[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ PDE10A Q9Y233 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ CA12 O43570 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ GAA P10253 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ AR P10275 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ GAPDH P04406 1/20 0.36

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
SCHEMBL12833900 0.84 HPGD (0.42) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL14115830 0.81 NPC1 (0.55) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL6368201 0.81 NPC1 (0.55) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL13405981 0.79 NPC1 (0.69) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL6800084 0.79 PARP1 (0.44) RAB9AKDM4EKMT2APOLBPARP1
SCHEMBL14091287 0.78 CA12 (0.48) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL14091252 0.74 NPC1 (0.53) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL14090249 0.74 MGAM (0.45) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL14091530 0.73 HPGD (0.43) HPGDSMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL12145568 0.73 ALDH1A1 (0.55) HPGDSMN1; SMN2NPC1RAB9AALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 — — US disclosed
US-8629147-B2 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION (US) 2014-01-14 — — US disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 — — US disclosed
US-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders CHEMBRIDGE CORPORATION 2008-08-28 — — 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-20080207635-A1 Heterocyclic compounds useful in the treatment of neoplastic diseases, inflammatory disorders and immunomodulatory disorders LCK, MALT1, MYD88 HPGD 496/4885SMN1; SMN2 3752/4885NPC1 2983/4885

“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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