SCHEMBL2492989

SCHEMBL2492989

Oc1cc(Cl)c(-c2noc(-c3cn4cc(C(F)(F)F)cc(Cl)c4n3)n2)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.49
NPC1 O15118 4/20 0.49
NFKB1 P19838 4/20 0.49
RAB9A P51151 4/20 0.49
NFKB2 Q00653 4/20 0.49
RELA Q04206 4/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
RECQL P46063 1/20 0.48
PKM P14618 1/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CHUK O15111 1/20 0.34
TXNRD1 Q16881 1/20 0.34
NOX4 Q9NPH5 1/20 0.34

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
SCHEMBL3340895 0.92 SMN1; SMN2 (0.49) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL13303877 0.92 NPC1 (0.49) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL13331123 0.91 SMN1; SMN2 (0.47) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL29334563 0.91 NPC1 (0.47) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL3340987 0.91 NPC1 (0.39) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL3340670 0.87 SMN1; SMN2 (0.50) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL23457268 0.87 NPC1 (0.49) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL3340982 0.86 NPC1 (0.51) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL3340394 0.86 SMN1; SMN2 (0.55) SMN1; SMN2NPC1NFKB1RAB9ANFKB2
SCHEMBL3340971 0.85 SMN1; SMN2 (0.53) SMN1; SMN2NPC1NFKB1RAB9ANFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339944-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE Oppilan Pharma Limited (GB) 2023-10-26 US disclosed
US-20230339944-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE Oppilan Pharma Limited (GB) 2023-10-26 US disclosed
JP-2023017862-A HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE オピラン ファーマ エルティーディー. 2023-02-07 JP disclosed
US-20210163485-A1 Heterocyclic Compounds for the Treatment of Disease OPPILAN PHARMA LTD (GB) 2021-06-03 US disclosed
US-20200325135-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE OPPILAN PHARMA LTD (GB) 2020-10-15 US disclosed
US-10683291-B2 Heterocyclic compounds for the treatment of disease OPPILAN PHARMA LTD. (GB) 2020-06-16 US disclosed
US-20200071327-A1 Prodrugs for the Treatment of Disease OPPILAN PHARMA LTD (GB) 2020-03-05 US disclosed
US-20190241556-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE OPPILAN PHARMA LTD. (GB) 2019-08-08 US disclosed
WO-2017083756-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE OPPILAN PHARMA LTD. (US) 2017-05-18 WO disclosed
EP-2370438-A1 IMIDAZO [1,2A]PYRIDINE DERIVATIVES, THEIR USE AS S1P1 AGONISTS AND METHODS FOR THEIR PRODUCTION Exelixis, Inc. (US) 2011-10-05 EP disclosed
US-20100160369-A1 S1P1 Agonists and Methods of Making And Using EXELIXIS, INC. (US) 2010-06-24 US disclosed
US-20100160369-A1 S1P1 Agonists and Methods of Making And Using EXELIXIS, INC. (US) 2010-06-24 US disclosed
US-20100160369-A1 S1P1 Agonists and Methods of Making And Using EXELIXIS, INC. (US) 2010-06-24 US disclosed
WO-2010065760-A1 IMIDAZO [1,2A] PYRIDINE DERIVATIVES, THEIR USE AS S1P1 AGONISTS AND METHODS FOR THEIR PRODUCTION EXELIXIS, INC. (US) 2010-06-10 WO disclosed
WO-2010065760-A1 IMIDAZO [1,2A] PYRIDINE DERIVATIVES, THEIR USE AS S1P1 AGONISTS AND METHODS FOR THEIR PRODUCTION EXELIXIS, INC. (US) 2010-06-10 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 (7 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-20200325135-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE VHL, FH, TPMT SMN1; SMN2 193/4885NPC1 144/4885NFKB1 907/4885
US-20210163485-A1 Heterocyclic Compounds for the Treatment of Disease VHL, FH, TPMT SMN1; SMN2 206/4885NPC1 144/4885NFKB1 900/4885
US-20200071327-A1 Prodrugs for the Treatment of Disease DPYD, PAICS, TYMP SMN1; SMN2 429/4885NPC1 649/4885NFKB1 2267/4885
US-20190241556-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE VHL, FH, TPMT SMN1; SMN2 193/4885NPC1 144/4885NFKB1 907/4885
US-10683291-B2 Heterocyclic compounds for the treatment of disease VHL, FH, TPMT SMN1; SMN2 193/4885NPC1 144/4885NFKB1 907/4885
US-20230339944-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE VHL, FH, TPMT SMN1; SMN2 193/4885NPC1 144/4885NFKB1 907/4885
US-20100160369-A1 S1P1 Agonists and Methods of Making And Using S1PR1, S1PR5, S1PR3 SMN1; SMN2 2046/4885NPC1 241/4885NFKB1 3452/4885

“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.