SCHEMBL258972

SCHEMBL258972

Cc1nc2cccc(C)n2n1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 1/20 0.50
CYP11B2 P19099 1/20 0.47
PDE10A Q9Y233 17/20 0.43
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 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
Formamide SCHEMBL28532491 0.89 EGLN2 (0.43) EGLN2CYP11B2PDE10A
SCHEMBL21807360 0.79 AHR (0.54) EGLN2CYP11B2PDE10ANPC1RAB9A
SCHEMBL543601 0.79 EGLN2 (0.47) EGLN2CYP11B2PDE10A
SCHEMBL30485242 0.79 CYP11B2 (0.45) CYP11B2PDE10ANPC1RAB9A
SCHEMBL13390440 0.79 CYP11B2 (0.53) CYP11B2PDE10ANPC1RAB9A
SCHEMBL13218425 0.79 CYP11B2 (0.45) CYP11B2PDE10AKDM4E
SCHEMBL3300546 0.79 NUDT1 (0.57) EGLN2CYP11B2PDE10AKDM4E
SCHEMBL19658704 0.76 EGLN2 (0.45) EGLN2CYP11B2PDE10A
SCHEMBL2036746 0.76 PDE10A (0.49) CYP11B2PDE10A
SCHEMBL19659205 0.76 EGLN2 (0.45) EGLN2CYP11B2PDE10A

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3889152-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu Hansoh Pharmaceutical Group Co., Ltd. (CN) 2021-10-06 EP disclosed
US-20210070754-A1 JAK INHIBITOR AND USE THEREOF ZHUHAI UNITED LABORATORIES CO., LTD. (CN) 2021-03-11 US disclosed
WO-2020108613-A1 HETEROAROMATIC DERIVATIVES FOR USE AS REGULATOR, PREPARATION METHOD THEREFOR AND USE THEREOF 江苏豪森药业集团有限公司 2020-06-04 WO disclosed
WO-2019149244-A1 JAK INHIBITOR AND USE THEREOF 南京明德新药研发股份有限公司 2019-08-08 WO disclosed
US-20180179209-A1 JAK INHIBITORS Wuxi Fortune Pharmaceutical Co., Ltd (CN) 2018-06-28 US disclosed
US-20180179209-A1 JAK INHIBITORS Wuxi Fortune Pharmaceutical Co., Ltd (CN) 2018-06-28 US disclosed
US-9994590-B2 Substituted [1,2,4]triazolo[1,5-a]pyrazines as phosphodiesterase inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2018-06-12 US disclosed
US-20170114064-A1 FUSED TRIAZOLE DERIVATIVES AS PHOSPHODIESTERASE 10A INHIBITORS CELON PHARMA S.A. (PL) 2017-04-27 US disclosed
US-9592230-B2 Substituted imidazoles as PDE10A inhibitors H. LUNDBECK A/S (DK) 2017-03-14 US disclosed
US-20170037060-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. 2017-02-09 US disclosed
US-20150322090-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. 2015-11-12 US disclosed
US-20150190395-A1 Novel Phenylimidazole Derivatives as PDE10A Enzyme Inhibitors H. LUNDBECK A/S (DK) 2015-07-09 US disclosed
US-9018217-B2 Phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2015-04-28 US disclosed
US-20150025081-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS H. LUNDBECK A/S (DK) 2015-01-22 US disclosed
US-8865711-B2 Phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2014-10-21 US disclosed
US-8431593-B2 Heteroaryl amide derivatives H. LUNDBECK A/S (DK) 2013-04-30 US disclosed
US-20120135987-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS H. LUNDBECK A/S (DK) 2012-05-31 US disclosed
US-8133897-B2 Phenylimidazole derivatives as PDE10A enzyme inhibitors H. LUNDBECK A/S (DK) 2012-03-13 US disclosed
US-20100216763-A1 Heteroaryl Amide Derivatives H. LUNDBECK A/S (DK) 2010-08-26 US disclosed
US-20100016303-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS H. LUNDBECK A/S (DK) 2010-01-21 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 (10 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-20100016303-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS PDE10A, PDE5A, PDE3B EGLN2 2987/4885CYP11B2 924/4885PDE10A 1/4885
US-20150322090-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN EGLN2 479/4885CYP11B2 58/4885PDE10A 2086/4885
US-20180179209-A1 JAK INHIBITORS JAK2, JAK1, JAK3 EGLN2 761/4885CYP11B2 2353/4885PDE10A 1057/4885
US-20170114064-A1 FUSED TRIAZOLE DERIVATIVES AS PHOSPHODIESTERASE 10A INHIBITORS PDE3B, PDE3A, PDE5A EGLN2 3130/4885CYP11B2 125/4885PDE10A 7/4885
US-20150190395-A1 Novel Phenylimidazole Derivatives as PDE10A Enzyme Inhibitors PDE10A, PDE5A, PDE3B EGLN2 2987/4885CYP11B2 924/4885PDE10A 1/4885
US-20170037060-A1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF COMT, GPR119, NLN EGLN2 479/4885CYP11B2 58/4885PDE10A 2086/4885
US-20210070754-A1 JAK INHIBITOR AND USE THEREOF JAK1, JAK2, TYK2 EGLN2 1473/4885CYP11B2 1047/4885PDE10A 1995/4885
US-20100216763-A1 Heteroaryl Amide Derivatives HCAR2, PIGS, GPR52 EGLN2 616/4885CYP11B2 415/4885PDE10A 2840/4885
US-20120135987-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS PDE10A, PDE5A, PDE3B EGLN2 2987/4885CYP11B2 924/4885PDE10A 1/4885
US-20150025081-A1 NOVEL PHENYLIMIDAZOLE DERIVATIVES AS PDE10A ENZYME INHIBITORS PDE10A, PDE5A, PDE3B EGLN2 2987/4885CYP11B2 924/4885PDE10A 1/4885

“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.