SCHEMBL6652409

SCHEMBL6652409

CCc1cc(NC(=S)N2CCN(c3ccccc3-c3ccccc3)CC2)c(OC)nc1C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
ATM Q13315 2/20 0.48
MEN1 O00255 1/20 0.46
CXCR3 P49682 1/20 0.45
KCNH2 Q12809 1/20 0.45
MAPT P10636 4/20 0.44
ALDH1A1 P00352 3/20 0.44
RECQL P46063 1/20 0.44
PHGDH O43175 1/20 0.44
LMNA P02545 2/20 0.42
PKM P14618 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL6653829 0.91 KMT2A (0.55) KMT2AATMMEN1ALDH1A1PHGDH
SCHEMBL8700902 0.90 CXCR3 (0.48) KMT2AMEN1CXCR3KCNH2MAPT
SCHEMBL6652670 0.88 PHGDH (0.58) KMT2AATMMEN1MAPTALDH1A1
SCHEMBL8701044 0.87 KMT2A (0.65) KMT2AATMMEN1MAPTALDH1A1
SCHEMBL6651274 0.87 MEN1 (0.54) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL6657797 0.85 KMT2A (0.48) KMT2AATMMEN1ALDH1A1PHGDH
SCHEMBL6657804 0.81 SMN1; SMN2 (0.46) KMT2AATMMEN1MAPTALDH1A1
SCHEMBL6653052 0.81 PHGDH (0.56) KMT2AMEN1MAPTALDH1A1PHGDH
SCHEMBL9057833 0.80 RBP4 (0.50) KMT2AMEN1MAPTALDH1A1PKM
SCHEMBL6653887 0.80 PHGDH (0.52) KMT2AMEN1ALDH1A1PHGDHLMNA

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 KMT2A 2664/4885ATM 4732/4885MEN1 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.