SCHEMBL24181578

SCHEMBL24181578

O=C1CCCN1c1cccc(Sc2cnc(Cl)cn2)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.41
▸ PTPN11 Q06124 10/20 0.40
▸ HTR6 P50406 1/20 0.38
▸ ALOX5AP P20292 1/20 0.34
▸ FEN1 P39748 1/20 0.34
▸ P2RX3 P56373 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ MAPK11 Q15759 1/20 0.32
▸ MAPK14 Q16539 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ NOTUM Q6P988 1/20 0.32
▸ CYP1A2 P05177 2/20 0.32
▸ CYP3A4 P08684 2/20 0.32
▸ CYP2D6 P10635 2/20 0.32
▸ CYP2C9 P11712 2/20 0.32
▸ HTR1A P08908 1/20 0.32
▸ HTR3A P46098 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32

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
SCHEMBL24181824 0.76 PTPN11 (0.36) PTPN11MAPK11MAPK14NOTUM
SCHEMBL24389162 0.76 NPC1 (0.46) CNR2P2RX3LMNACYP1A2CYP3A4
SCHEMBL24181588 0.73 SMN1; SMN2 (0.38) CNR2LMNACYP1A2CYP3A4CYP2D6
SCHEMBL29604196 0.73 SMN1; SMN2 (0.38) CNR2LMNACYP1A2CYP3A4CYP2D6
SCHEMBL18319628 0.71 PTPN11 (0.55) PTPN11KCNH2ALDH1A1
SCHEMBL30899412 0.71 NPC1 (0.38) PTPN11LMNANOTUMALDH1A1
SCHEMBL27182421 0.71 NPC1 (0.38) PTPN11LMNANOTUMALDH1A1
SCHEMBL27082924 0.71 PTPN11 (0.47) PTPN11KCNH2LMNANOTUMCYP1A2
SCHEMBL30835350 0.71 PTPN11 (0.47) PTPN11KCNH2LMNANOTUMCYP1A2
SCHEMBL1771750 0.70 POLB (0.44) CNR2LMNACYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11827644-B2 Pyrazine derivative and application thereof in inhibiting SHP2 SUZHOU GENHOUSE PHARMACEUTICAL CO., LTD (CN) 2023-11-28 — — US disclosed
US-11827644-B2 Pyrazine derivative and application thereof in inhibiting SHP2 SUZHOU GENHOUSE PHARMACEUTICAL CO., LTD (CN) 2023-11-28 — — US disclosed
US-20230227464-A1 PYRAZINE DERIVATIVE AND APPLICATION THEREOF IN INHIBITING SHP2 SUZHOU GENHOUSE PHARMACEUTICAL CO., LTD (CN) 2023-07-20 — — US disclosed
US-20230227464-A1 PYRAZINE DERIVATIVE AND APPLICATION THEREOF IN INHIBITING SHP2 SUZHOU GENHOUSE PHARMACEUTICAL CO., LTD (CN) 2023-07-20 — — US disclosed
US-20220127276-A1 PYRAZINE DERIVATIVE AND APPLICATION THEREOF IN INHIBITING SHP2 SUZHOU GENHOUSE PHARMACEUTICAL CO., LTD (CN) 2022-04-28 — — US disclosed
EP-3936502-A1 PYRAZINE DERIVATIVE AND APPLICATION THEREOF IN INHIBITING SHP2 Suzhou Genhouse Pharmaceutical Co., Ltd. (CN) 2022-01-12 — — EP 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 (3 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-11827644-B2 Pyrazine derivative and application thereof in inhibiting SHP2 PTPN5, PTPN1, PTPN7 CNR2 2347/4885PTPN11 7/4885HTR6 3956/4885
US-20220127276-A1 PYRAZINE DERIVATIVE AND APPLICATION THEREOF IN INHIBITING SHP2 PTPN5, PTPN1, PTPN7 CNR2 2347/4885PTPN11 7/4885HTR6 3956/4885
US-20230227464-A1 PYRAZINE DERIVATIVE AND APPLICATION THEREOF IN INHIBITING SHP2 PTPN5, PTPN1, PTPN7 CNR2 2347/4885PTPN11 7/4885HTR6 3956/4885

“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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