SCHEMBL16246895

SCHEMBL16246895

O=C(O)c1cn(Cc2csc(-c3ccccc3)n2)cn1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ DRD2 P14416 3/20 0.50
▸ DRD4 P21917 2/20 0.50
▸ DRD3 P35462 2/20 0.50
▸ KDM4E B2RXH2 2/20 0.48
▸ RAB9A P51151 4/20 0.47
▸ PRNP P04156 1/20 0.47
▸ AKR1B1 P15121 1/20 0.47
▸ HPGDS O60760 1/20 0.46
▸ ACKR3 P25106 1/20 0.46
▸ DNM1L O00429 1/20 0.45
▸ MAPT P10636 2/20 0.44
▸ KLKB1 P03952 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ GAA P10253 1/20 0.44

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
SCHEMBL3688462 0.76 KDM4C (0.57) RAB9AHPGDSKLKB1NPC1TSHR
SCHEMBL28271026 0.75 DRD2 (0.63) MEN1KMT2ADRD2DRD4DRD3
SCHEMBL16246855 0.72 KLKB1 (0.67) MEN1KMT2ADRD2DRD4DRD3
SCHEMBL352152 0.71 HPGDS (0.73) KDM4ERAB9AHPGDSMAPTL3MBTL1
SCHEMBL21355020 0.71 PTGS1 (0.57) KDM4ERAB9AMAPTKLKB1HPGD
SCHEMBL28229261 0.71 DNM1L (0.53) MEN1KMT2ADRD2DRD4DRD3
SCHEMBL21875358 0.71 DNM1L (0.73) MEN1KMT2ADNM1LKLKB1
SCHEMBL17503953 0.71 KLKB1 (0.68) MEN1KMT2ADRD2DRD4DRD3
SCHEMBL1422234 0.70 LMNA (0.74) MEN1KMT2AKDM4ERAB9APRNP
Hydrochloric Acid SCHEMBL6821751 0.70 HPGDS (0.71) KDM4ERAB9AHPGDSMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105452240-B Hete rocyclic derivatives 卡尔维斯塔制药有限公司 2018-06-26 — — CN disclosed
EP-3305778-A1 INHIBITORS OF PLASMA KALLIKREIN Kalvista Pharmaceuticals Limited (GB) 2018-04-11 — — EP disclosed
EP-2999697-B1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LTD (GB) 2017-04-19 — — EP disclosed
US-9533987-B2 Heterocyclic derivates KALVISTA PHARMACEUTICALS LIMITED (GB) 2017-01-03 — — US disclosed
US-20160108036-A1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LIMITED (GB) 2016-04-21 — — US disclosed
EP-2999697-A1 HETEROCYCLIC DERIVATES Kalvista Pharmaceuticals Limited (GB) 2016-03-30 — — EP disclosed
CN-105452240-A Heterocyclic derivates KALVISTA PHARMACEUTICALS LTD 2016-03-30 — — CN disclosed
WO-2014188211-A1 HETEROCYCLIC DERIVATES KALVISTA PHARMACEUTICALS LIMITED (GB) 2014-11-27 — — WO 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-20160108036-A1 HETEROCYCLIC DERIVATES BDKRB1, KLKB1, BDKRB2 MEN1 341/4885KMT2A 1343/4885DRD2 3352/4885

“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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