SCHEMBL2323323

SCHEMBL2323323

O=C(OCc1ccccc1)N1CC(c2ncc3c(Cl)nccn23)C1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.43
OPRK1 P41145 1/20 0.43
JAK2 O60674 3/20 0.42
JAK1 P23458 3/20 0.42
GRIN2B Q13224 8/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CYP2D6 P10635 4/20 0.41
CYP2C9 P11712 4/20 0.41
CYP3A4 P08684 3/20 0.41
CYP2C19 P33261 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TYK2 P29597 1/20 0.38
JAK3 P52333 1/20 0.38

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
SCHEMBL21050978 0.92 SMN1; SMN2 (0.46) OPRD1OPRK1JAK2JAK1GRIN2B
SCHEMBL28938318 0.92 SMN1; SMN2 (0.46) OPRD1OPRK1JAK2JAK1GRIN2B
SCHEMBL14654247 0.91 JAK2 (0.47) OPRD1OPRK1JAK2JAK1GRIN2B
SCHEMBL14647469 0.91 JAK2 (0.47) OPRD1OPRK1JAK2JAK1GRIN2B
SCHEMBL593236 0.90 SMN1; SMN2 (0.50) OPRD1OPRK1JAK2JAK1GRIN2B
SCHEMBL2327296 0.88 JAK2 (0.44) OPRD1OPRK1JAK2JAK1GRIN2B
SCHEMBL2323403 0.85 GRIN2B (0.43) OPRD1OPRK1GRIN2BSMN1; SMN2NPC1
SCHEMBL2323399 0.85 GRIN2B (0.43) OPRD1OPRK1GRIN2BSMN1; SMN2NPC1
SCHEMBL15878148 0.83 F2 (0.38) OPRD1OPRK1GRIN2BSMN1; SMN2NPC1
SCHEMBL15877464 0.83 F2 (0.38) OPRD1OPRK1GRIN2BSMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109715626-B Heterocyclic compounds as FGFR inhibitors 广州诺诚健华医药科技有限公司 2022-04-26 CN disclosed
US-10752631-B2 Heterocyclic compounds as FGFR inhibitors GUANGZHOU INNOCARE PHARMA TECH CO., LTD. (CN) 2020-08-25 US disclosed
EP-3498706-A1 HETEROCYCLIC COMPOUND AS FGFR INHIBITOR Guangzhou InnoCare Pharma Tech Co., Ltd. (CN) 2019-06-19 EP disclosed
US-20190177333-A1 HETEROCYCLIC COMPOUNDS AS FGFR INHIBITOR GUANGZHOU INNOCARE PHARMA TECH CO., LTD. (CN) 2019-06-13 US disclosed
EP-2534151-B1 8-METHYL-1-PHENYL-IMIDAZOL[1,5-A]PYRAZINE COMPOUNDS MERCK SHARP & DOHME (NL) 2018-11-14 EP disclosed
US-8658794-B2 8-methyl-1-phenyl-imidazol[1,5-a]pyrazine compounds as Lck inhibitors and uses thereof MERCK SHARP & DOHME B.V. (NL) 2014-02-25 US disclosed
EP-2534151-A1 8-METHYL-1-PHENYL-IMIDAZOL[1,5-A]PYRAZINE COMPOUNDS MSD Oss B.V. (NL) 2012-12-19 EP disclosed
US-20120309966-A1 8-METHYL-1-PHENYL-IMIDAZOL[1,5-A]PYRAZINE COMPOUNDS N.V. ORGANON (NL) 2012-12-06 US disclosed
WO-2011095556-A1 8-METHYL-1-PHENYL-IMIDAZOL[1,5-A]PYRAZINE COMPOUNDS N.V. ORGANON (NL) 2011-08-11 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 (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-20120309966-A1 8-METHYL-1-PHENYL-IMIDAZOL[1,5-A]PYRAZINE COMPOUNDS LCK, ZAP70, FYN OPRD1 2856/4885OPRK1 1333/4885JAK2 155/4885
US-20190177333-A1 HETEROCYCLIC COMPOUNDS AS FGFR INHIBITOR FGFR1, FGFR3, FGFR2 OPRD1 3839/4885OPRK1 3566/4885JAK2 73/4885
US-10752631-B2 Heterocyclic compounds as FGFR inhibitors FGFR1, FGFR3, FGFR2 OPRD1 3870/4885OPRK1 3589/4885JAK2 72/4885

“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.