SCHEMBL7203616

SCHEMBL7203616

O=C(C=Cc1cccs1)c1ccc(Br)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 1.00
ABCG2 Q9UNQ0 2/20 0.74
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
ALDH1A1 P00352 2/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
POLB P06746 1/20 0.63
RAB9A P51151 4/20 0.60
NPC1 O15118 3/20 0.60
CASP3 P42574 1/20 0.60
SENP8 Q96LD8 1/20 0.60
SENP7 Q9BQF6 1/20 0.60
SENP6 Q9GZR1 1/20 0.60
LMNA P02545 6/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
HCAR2 Q8TDS4 1/20 0.57
CYP1B1 Q16678 1/20 0.57
CA1 P00915 1/20 0.53

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
SCHEMBL7203615 1.00 MAPT (1.00) MAPTABCG2MEN1KMT2AALDH1A1
SCHEMBL28708176 0.85 ABCG2 (1.00) MAPTABCG2MEN1KMT2AALDH1A1
SCHEMBL11477089 0.85 ABCG2 (0.77) MAPTABCG2MEN1KMT2AALDH1A1
SCHEMBL17429547 0.85 ABCG2 (1.00) MAPTABCG2MEN1KMT2AALDH1A1
SCHEMBL11477087 0.85 ABCG2 (0.77) MAPTABCG2MEN1KMT2AALDH1A1
SCHEMBL8663226 0.85 ABCG2 (0.76) MAPTABCG2MEN1KMT2AALDH1A1
SCHEMBL8078718 0.85 ABCG2 (0.76) MAPTABCG2MEN1KMT2AALDH1A1
SCHEMBL3035766 0.84 ABCG2 (0.74) MAPTABCG2MEN1KMT2AALDH1A1
SCHEMBL3035768 0.84 ABCG2 (0.74) MAPTABCG2MEN1KMT2AALDH1A1
SCHEMBL31301136 0.84 ABCG2 (0.74) MAPTABCG2MEN1KMT2AALDH1A1

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 MAPT 4683/4885ABCG2 3097/4885MEN1 4820/4885

“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.