SCHEMBL7204246

SCHEMBL7204246

CCCCC(=O)N1N=C(c2ccc(Cl)cc2)CC1c1cccs1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.67
▸ ATM Q13315 1/20 0.67
▸ RAB9A P51151 1/20 0.62
▸ RCE1 Q9Y256 1/20 0.62
▸ L3MBTL1 Q9Y468 1/20 0.62
▸ KMT2A Q03164 2/20 0.61
▸ ALDH1A1 P00352 6/20 0.59
▸ KDM4E B2RXH2 5/20 0.59
▸ GAA P10253 2/20 0.58
▸ YAP1 P46937 1/20 0.54
▸ TEAD4 Q15561 1/20 0.54
▸ PKM P14618 2/20 0.54
▸ GLA P06280 1/20 0.54

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
SCHEMBL7203372 0.94 RAB9A (0.64) HTTATMRAB9ARCE1L3MBTL1
SCHEMBL7962781 0.89 ALDH1A1 (0.65) HTTATMRAB9ARCE1L3MBTL1
SCHEMBL7203467 0.85 ALDH1A1 (0.60) HTTATMRAB9ARCE1L3MBTL1
SCHEMBL7200572 0.84 RAB9A (0.63) HTTATMRAB9ARCE1L3MBTL1
SCHEMBL14541158 0.84 HTT (0.59) HTTATMRAB9ARCE1L3MBTL1
SCHEMBL7202496 0.83 KDM4E (0.70) HTTRAB9AKMT2AALDH1A1KDM4E
SCHEMBL7206095 0.83 ALDH1A1 (0.60) HTTATMRAB9ARCE1L3MBTL1
SCHEMBL7205965 0.82 KMT2A (0.66) RAB9AKMT2AALDH1A1KDM4EYAP1
SCHEMBL7202706 0.82 MAOB (0.60) HTTATMRAB9ARCE1L3MBTL1
SCHEMBL7855629 0.81 ALDH1A1 (0.58) HTTATMRAB9ARCE1L3MBTL1

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-6605730-B2 3-(2-Thienyl)-5-phenyl-1H-pyrazole compounds of given formula NIHON BAYER AGROCHEM K.K. (JP) 2003-08-12 — — US disclosed
US-20030028034-A1 Nematicidal pyrazoles WADA KATSUAKI (JP) 2003-02-06 — — US disclosed
US-6310049-B1 3-(2-THIENYL),5-(SUBSTITUTED PHENYL)-1H-PYRAZOLES AND 3-(SUBSTITUTED PHENYL),5-(2-THIENYL)-1H-PYRAZOLES OF GIVEN FORMULA; ANTHELMINTICS NIHON BAYER AGROCHEM K.K. (JP) 2001-10-30 — — US disclosed
EP-1104418-A2 NEMATICIDAL PYRAZOLES NIHON BAYER AGROCHEM K.K. (JP) 2001-06-06 — — EP disclosed
WO-2000009500-A2 NEMATICIDAL PYRAZOLES NIHON BAYER AGROCHEM K.K. (JP) 2000-02-24 — — 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 (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-20030028034-A1 Nematicidal pyrazoles CBR3, CBR1, CCR4 HTT 3125/4885ATM 4472/4885RAB9A 1643/4885

“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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