SCHEMBL14226374

SCHEMBL14226374

Cc1nc(C)nc(/C=C2\SC(=S)NC2=O)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.52
▸ GAA P10253 3/20 0.52
▸ NAT1 P18440 3/20 0.51
▸ MEN1 O00255 3/20 0.50
▸ POLB P06746 3/20 0.50
▸ MAPT P10636 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ CISD1 Q9NZ45 2/20 0.50
▸ PSMD14 O00487 2/20 0.50
▸ MMP2 P08253 2/20 0.50
▸ RECQL P46063 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ MAOA P21397 1/20 0.50
▸ ALPL P05186 1/20 0.50
▸ ALPI P09923 1/20 0.50
▸ ALPG P10696 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ LMNA P02545 1/20 0.50

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
SCHEMBL15304596 0.86 MYC (0.46) ALDH1A1GAANAT1MEN1POLB
SCHEMBL15101830 0.83 PIM1 (0.54) GAANAT1MEN1POLBKMT2A
SCHEMBL15097021 0.76 MYC (0.51) ALDH1A1GAANAT1MEN1POLB
SCHEMBL9428429 0.76 PTGS2 (0.56) ALDH1A1GAANAT1MEN1POLB
SCHEMBL9428425 0.76 PTGS2 (0.56) ALDH1A1GAANAT1MEN1POLB
SCHEMBL265234 0.70 — —
SCHEMBL8358185 0.70 — —
SCHEMBL15989509 0.70 — —
SCHEMBL8167434 0.70 PIM1 (0.75) NAT1CISD1HPGDNPC1MAOA
SCHEMBL8167436 0.70 PIM1 (0.75) NAT1CISD1HPGDNPC1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2541329-A1 CHARGE CONTROLLING AGENT AND TONER USING SAME Hodogaya Chemical Co., Ltd. (JP) 2013-01-02 — — EP disclosed
US-20120315576-A1 CHARGE CONTROLLING AGENT AND TONER USING SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2012-12-13 — — US disclosed
US-20120315576-A1 CHARGE CONTROLLING AGENT AND TONER USING SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2012-12-13 — — 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 (1 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-20120315576-A1 CHARGE CONTROLLING AGENT AND TONER USING SAME NPY1R, HCRTR1, CCKAR ALDH1A1 4635/4885GAA 1140/4885NAT1 1604/4885

“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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