SCHEMBL22263137

SCHEMBL22263137

c1ccc(CN2CN=C(SCc3ccccc3CSC3=NCN(Cc4ccccc4)CN3)NC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 3/20 0.50
▸ ALDH1A1 P00352 3/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ KMT2A Q03164 4/20 0.44
▸ LMNA P02545 1/20 0.44
▸ GAA P10253 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ CYP2C19 P33261 1/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ THRB P10828 1/20 0.39
▸ SIGMAR1 Q99720 3/20 0.39
▸ NPC1 O15118 1/20 0.37
▸ MC4R P32245 1/20 0.37

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
SCHEMBL20918028 0.91 CYP1A2 (0.44) MAPK1ALDH1A1TDP1KMT2ALMNA
SCHEMBL22263183 0.88 ALDH1A1 (0.53) MAPK1ALDH1A1KMT2ALMNAGAA
SCHEMBL20920186 0.86 CYP1A2 (0.49) MAPK1ALDH1A1KMT2ALMNAGAA
SCHEMBL20920201 0.86 KDM4E (0.41) MAPK1ALDH1A1KMT2ALMNAGAA
SCHEMBL22263119 0.86 ALDH1A1 (0.43) MAPK1ALDH1A1KMT2ALMNACYP1A2
SCHEMBL19061440 0.84 MAPK1 (0.46) MAPK1ALDH1A1TDP1LMNAGAA
SCHEMBL22263126 0.84 HTT (0.41) MAPK1ALDH1A1KMT2ALMNACYP1A2
SCHEMBL20920185 0.84 CYP1A2 (0.42) MAPK1KMT2ALMNACYP1A2CYP2D6
SCHEMBL19061884 0.84 KMT2A (0.49) MAPK1ALDH1A1KMT2ALMNATSHR
SCHEMBL19019922 0.82 MAPK1 (0.50) MAPK1ALDH1A1TDP1KMT2AGAA

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 5 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

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 MAPK1 1048/4885ALDH1A1 3331/4885TDP1 637/4885
US-20200239452-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 MAPK1 1048/4885ALDH1A1 3331/4885TDP1 637/4885
US-20250092020-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 MAPK1 1048/4885ALDH1A1 3331/4885TDP1 637/4885
US-20220380305-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 MAPK1 831/4885ALDH1A1 3591/4885TDP1 652/4885

“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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