SCHEMBL20932776

SCHEMBL20932776

COc1ccc(CN2CN=C(SCc3ccccc3CSC3=NCN(Cc4ccc(OC)cc4OC)CN3)NC2)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ ALDH1A1 P00352 3/20 0.47
▸ MAPT P10636 1/20 0.47
▸ TSHR P16473 3/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ GAA P10253 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ POLB P06746 2/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ APLNR P35414 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39

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
SCHEMBL20920186 0.85 CYP1A2 (0.49) KDM4EMAPK1ALDH1A1MAPTLMNA
SCHEMBL22263111 0.76 KMT2A (0.40) KDM4EALDH1A1MAPTTSHRLMNA
SCHEMBL22263137 0.76 MAPK1 (0.50) MAPK1ALDH1A1TSHRLMNAMEN1
SCHEMBL20932675 0.75 SIGMAR1 (0.41) MEN1KMT2AGAA
SCHEMBL19062036 0.74 POLB (0.44) KDM4EMAPK1MEN1KMT2ASMN1; SMN2
SCHEMBL20917818 0.74 KMT2A (0.46) KDM4EALDH1A1MAPTTSHRLMNA
SCHEMBL20918028 0.73 CYP1A2 (0.44) KDM4EMAPK1ALDH1A1TSHRLMNA
SCHEMBL20932242 0.73 SIGMAR1 (0.41) LMNAKMT2AGAACYP1A2CYP3A4
SCHEMBL22263119 0.72 ALDH1A1 (0.43) MAPK1ALDH1A1TSHRLMNAMEN1
SCHEMBL22263126 0.72 HTT (0.41) KDM4EMAPK1ALDH1A1MAPTTSHR

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-20250092020-A1 IDO/TDO Inhibitor GENERAL INCORPORATED ASSOCIATION PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2025-03-20 — — US disclosed
US-12209079-B2 IDO/TDO inhibitor GENERAL INCORPORATED ASSOCIATION PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2025-01-28 — — US disclosed
US-20220380305-A1 IDO/TDO Inhibitor CANBAS CO., LTD. 2022-12-01 — — US disclosed
US-20200239452-A1 IDO/TDO Inhibitor CANBAS CO., LTD. (JP) 2020-07-30 — — US disclosed
US-20200239452-A1 IDO/TDO Inhibitor CANBAS CO., LTD. (JP) 2020-07-30 — — US disclosed
WO-2019078246-A1 IDO/TDO INHIBITOR 一般社団法人ファルマバレープロジェクト支援機構 2019-04-25 — — 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 (4 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-12209079-B2 IDO/TDO inhibitor IDO1, IDO2, TDO2 KDM4E 1315/4885MAPK1 1048/4885ALDH1A1 3331/4885
US-20200239452-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 KDM4E 1315/4885MAPK1 1048/4885ALDH1A1 3331/4885
US-20250092020-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 KDM4E 1315/4885MAPK1 1048/4885ALDH1A1 3331/4885
US-20220380305-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 KDM4E 751/4885MAPK1 831/4885ALDH1A1 3591/4885

“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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