SCHEMBL6653887

SCHEMBL6653887

CCc1cc(NC(=S)N2CCN(c3cc(C)cc(C)c3)CC2)c(OC)nc1C

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PHGDH O43175 7/20 0.52
CYP3A4 P08684 2/20 0.47
MEN1 O00255 1/20 0.46
PKM P14618 1/20 0.46
KMT2A Q03164 1/20 0.46
CYP2C19 P33261 1/20 0.45
LMNA P02545 3/20 0.42
ALDH1A1 P00352 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL6651279 0.91 PHGDH (0.53) PHGDHCYP3A4CYP2C19LMNAALDH1A1
SCHEMBL6653052 0.91 PHGDH (0.56) PHGDHCYP3A4MEN1PKMKMT2A
SCHEMBL6654791 0.90 PHGDH (0.43) PHGDHCYP3A4KMT2ACYP2C19LMNA
SCHEMBL6651274 0.89 MEN1 (0.54) CYP3A4MEN1KMT2ACYP2C19LMNA
SCHEMBL6956284 0.88 RBP4 (0.43) PHGDHMEN1KMT2ALMNAALDH1A1
SCHEMBL6657881 0.87 PHGDH (0.56) PHGDHCYP3A4MEN1PKMKMT2A
SCHEMBL6652348 0.86 KMT2A (0.46) PHGDHMEN1KMT2ALMNAALDH1A1
SCHEMBL6674781 0.86 PHGDH (0.38) PHGDHCYP3A4MEN1PKMKMT2A
SCHEMBL8699119 0.85 KDM4E (0.55) PHGDHCYP3A4MEN1PKMKMT2A
SCHEMBL6653829 0.84 KMT2A (0.55) PHGDHMEN1PKMKMT2ALMNA

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-1424072-A1 N'-(pyridin-3-yl)-(4-phenylpiperazin-1-yl)-carboxyimidamide and -iminothiolate derivatives for the treatment of tumors Samjin Pharmaceutical Co., Ltd. (KR) 2004-06-02 EP disclosed
US-6683184-B2 ANTITUMOR AGENTS SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2004-01-27 US disclosed
US-20030092910-A1 Piperazine derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2003-05-15 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-20030092910-A1 Piperazine derivatives and process for the preparation thereof CBR1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCCS PHGDH 2923/4885CYP3A4 339/4885MEN1 3862/4885

“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.