SCHEMBL13116022

SCHEMBL13116022

CNc1cc(C)cc(Cl)n1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NOS3 P29474 1/20 0.61
▸ NOS2 P35228 1/20 0.61
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ S1PR2 O95136 3/20 0.35
▸ NUDT1 P36639 4/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ PGK1 P00558 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ HIF1A Q16665 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31

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
SCHEMBL30689573 1.00 NOS3 (0.61) NOS3NOS2SMN1; SMN2NPC1RAB9A
SCHEMBL18689678 0.80 ALDH1A1 (0.43) NOS3NOS2SMN1; SMN2S1PR2ALDH1A1
SCHEMBL21922822 0.79 NOS3 (0.41) NOS3NOS2SMN1; SMN2NPC1RAB9A
SCHEMBL3711167 0.77 MEN1 (0.47) NOS3NOS2SMN1; SMN2NPC1RAB9A
SCHEMBL29849205 0.77 MEN1 (0.47) NOS3NOS2SMN1; SMN2NPC1RAB9A
SCHEMBL165100 0.77 — —
SCHEMBL16454931 0.77 PGK1 (0.38) NOS3NOS2S1PR2PGK1CYP2C19
SCHEMBL19225767 0.77 TRPM8 (0.42) NOS3NOS2S1PR2ALDH1A1POLB
SCHEMBL943294 0.76 NOS3 (1.00) NOS3NOS2SMN1; SMN2NPC1RAB9A
SCHEMBL2771693 0.75 NOS3 (0.35) NOS3NOS2SMN1; SMN2S1PR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4320112-B1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2025-05-14 — — EP disclosed
US-20240376082-A1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2024-11-14 — — US disclosed
EP-4320112-A1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS Bristol-Myers Squibb Company (US) 2024-02-14 — — EP disclosed
US-20230303527-A1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS BRISTOL MYERS SQUIBB CO (US) 2023-09-28 — — US disclosed
US-11718601-B2 Pyridinyl substituted oxoisoindoline compounds BRISTOL-MYERS SQUIBB COMPANY (US) 2023-08-08 — — US disclosed
WO-2022216644-A1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY (US) 2022-10-13 — — WO disclosed
US-20220324840-A1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS BRISTOL-MYERS SQUIBB COMPANY 2022-10-13 — — US disclosed
EP-2789606-B1 Modulators of CFTR VERTEX PHARMA (US) 2017-11-15 — — EP disclosed
EP-3004110-B1 PYRAZOLOPYRROLIDINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE NOVARTIS AG (CH) 2017-07-26 — — EP disclosed
US-20100273780-A1 SUBSTITUTED 8-HETEROARYL XANTHINES PGXHEALTH, LLC (US) 2010-10-28 — — US disclosed
US-20100273780-A1 SUBSTITUTED 8-HETEROARYL XANTHINES PGXHEALTH, LLC (US) 2010-10-28 — — US disclosed
US-7732455-B2 Substituted 8-heteroaryl xanthines PGX HEALTH, LLC (US) 2010-06-08 — — US disclosed
US-7732455-B2 Substituted 8-heteroaryl xanthines PGX HEALTH, LLC (US) 2010-06-08 — — US disclosed
US-20080200456-A1 Substituted 8-Heteroaryl Xanthines ALLERGAN SALES, LLC 2008-08-21 — — US disclosed
US-20080200456-A1 Substituted 8-Heteroaryl Xanthines ALLERGAN SALES, LLC 2008-08-21 — — US disclosed
US-7342006-B2 Substituted 8-heteroaryl xanthines ADENOSINE THERAPEUTICS, LLC (US) 2008-03-11 — — US disclosed
US-7342006-B2 Substituted 8-heteroaryl xanthines ADENOSINE THERAPEUTICS, LLC (US) 2008-03-11 — — 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 (6 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-11718601-B2 Pyridinyl substituted oxoisoindoline compounds HNRNPH3, RPL17, RTF2 NOS3 2409/4885NOS2 2258/4885SMN1; SMN2 669/4885
US-20240376082-A1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS HNRNPH3, RPL17, RTF2 NOS3 2409/4885NOS2 2258/4885SMN1; SMN2 669/4885
US-20080200456-A1 Substituted 8-Heteroaryl Xanthines ADORA2B, ADORA2A, ADORA3 NOS3 2978/4885NOS2 3119/4885SMN1; SMN2 3702/4885
US-20230303527-A1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS HNRNPH3, RPL17, RTF2 NOS3 2409/4885NOS2 2258/4885SMN1; SMN2 669/4885
US-20100273780-A1 SUBSTITUTED 8-HETEROARYL XANTHINES ADORA2B, ADORA2A, ADORA3 NOS3 2978/4885NOS2 3119/4885SMN1; SMN2 3702/4885
US-20220324840-A1 PYRIDINYL SUBSTITUTED OXOISOINDOLINE COMPOUNDS HNRNPH3, RPL17, RTF2 NOS3 2409/4885NOS2 2258/4885SMN1; SMN2 669/4885

“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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