SCHEMBL7635249

SCHEMBL7635249

Cc1ccc(F)c(Br)c1Cl

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 2/20 0.33
ACHE P22303 1/20 0.33
CYP3A4 P08684 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.32
PTGS2 P35354 3/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
PTGS1 P23219 1/20 0.30

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
SCHEMBL11949600 0.81 ACHE (0.33) P2RX7ACHECYP3A4RAPGEF4HDAC1
SCHEMBL31713181 0.79 TNF (0.38)
SCHEMBL21598620 0.79 TNF (0.38)
SCHEMBL2578269 0.77 ACHE (0.38) P2RX7ACHECYP3A4RAPGEF4
SCHEMBL11261447 0.77 ACHE (0.38) ACHEHDAC1HDAC6
SCHEMBL4448667 0.75 ALDH1A1 (0.36) CYP3A4
SCHEMBL8249627 0.75 ACHE (0.36) P2RX7ACHECYP3A4RAPGEF4
SCHEMBL4623500 0.75 ACHE (0.36) ACHEPTGS2HDAC1HDAC6PTGS1
SCHEMBL31559780 0.75 CYP3A4 (0.35) CYP3A4
SCHEMBL29071566 0.75 HTR2A (0.32)

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020032337-A1 Process for producing substituted arylpyrazoles LANTZSCH REINHARD (DE) 2002-03-14 US claimed
CN-1220662-A Process for preparing substituted arylpyrazoles BAYER AG (DE) 1999-06-23 CN claimed
EP-0904267-A1 PROCESS FOR PRODUCING SUBSTITUTED ARYL PYRAZOLES BAYER AG (DE) 1999-03-31 EP claimed
WO-1997046534-A1 PROCESS FOR PRODUCING SUBSTITUTED ARYL PYRAZOLES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-11 WO claimed
CN-101263131-B Urea glucokinase activators TRANSTECH PHARMA INC 2013-04-24 CN disclosed
CN-102675221-A Intermediate in method for preparing pyrimidinedione derivative TAKEDA PHARMACEUTICAL 2012-09-19 CN disclosed
CN-102140090-A Dipeptidyl peptidase inhibitors TAKEDA PHARMACEUTICAL 2011-08-03 CN disclosed
CN-102134230-A Dipeptidyl peptidase inhibitors TAKEDA PHARMACEUTICAL 2011-07-27 CN disclosed
CN-102134229-A Dipeptidyl peptidase inhibitors TAKAEDA CHEMICAL IND LTD 2011-07-27 CN disclosed
CN-102134231-A Dipeptidyl peptidase inhibitors TAKEDA PHARMACEUTICAL 2011-07-27 CN disclosed
CN-102127053-A Dipeptidyl peptidase inhibitors TAKEDA PHARMACEUTICAL 2011-07-20 CN disclosed
CN-102127057-A Dipeptidyl peptidase inhibitors TAKEDA PHARMACEUTICAL 2011-07-20 CN disclosed
CN-1096449-C Process for preparing substituted arylpyrazoles BAYER AG (DE) 2002-12-18 CN disclosed
US-6433210-B1 HALOGENOARENE REACTED WITH A SUBSTITUTED ALKYNE, SUSBSTITUTED ARYLALKYNE FORMED IS REACTED WITH SODIUM HYDROXIDE AND THEN AN ACYLATING AGENT, AND THE ARYLALKINONE FORMED IS REACTED WITH HYDRAZINE BAYER AKTIENGESELLSCHAFT (DE) 2002-08-13 US disclosed
US-20020032337-A1 Process for producing substituted arylpyrazoles LANTZSCH REINHARD (DE) 2002-03-14 US disclosed
US-6118031-A Process for producing substituted arylpyrazoles BAYER AKTIENGESELLSCHAFT (DE) 2000-09-12 US disclosed
US-6060605-A Process for producing substituted arylpyrazoles BAYER AKTIENGESELLSCHAFT (DE) 2000-05-09 US disclosed
CN-1220662-A Process for preparing substituted arylpyrazoles BAYER AG (DE) 1999-06-23 CN disclosed
EP-0904267-A1 PROCESS FOR PRODUCING SUBSTITUTED ARYL PYRAZOLES BAYER AG (DE) 1999-03-31 EP disclosed
WO-1997046534-A1 PROCESS FOR PRODUCING SUBSTITUTED ARYL PYRAZOLES BAYER AKTIENGESELLSCHAFT (DE) 1997-12-11 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-20020032337-A1 Process for producing substituted arylpyrazoles CYP2F1, CYP1A1, CYP1B1 P2RX7 2180/4885ACHE 4214/4885CYP3A4 4/4885

“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.