SCHEMBL5749533

SCHEMBL5749533

Cc1c(Cc2cccc(Cl)c2)c(C(C)C)nn1CCO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 5/20 0.47
CCR5 P51681 1/20 0.47
ADCY10 Q96PN6 2/20 0.43
PDE5A O76074 1/20 0.39
PDE9A O76083 1/20 0.39
PDE1A P54750 1/20 0.39
PDE1B Q01064 1/20 0.39
PDE1C Q14123 1/20 0.39
TSHR P16473 1/20 0.39
RECQL P46063 1/20 0.39
PNMT P11086 1/20 0.38
FSCN1 Q16658 1/20 0.38
PDE2A O00408 1/20 0.38
P2RX7 Q99572 1/20 0.38
ENPP1 P22413 1/20 0.37
MAOB P27338 1/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37

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
SCHEMBL5750247 0.87 CCR2 (0.43) CCR2CCR5ADCY10P2RX7KMT2A
SCHEMBL5749456 0.87 ADCY10 (0.41) CCR2CCR5ADCY10TSHRP2RX7
SCHEMBL5749688 0.83 CCR2 (0.47) CCR2CCR5PDE5APDE9APDE1A
SCHEMBL5750990 0.79 P2RX7 (0.36) CCR2CCR5PDE5APDE2AP2RX7
SCHEMBL5751512 0.75 CCR2 (0.44) CCR2CCR5ADCY10PDE5APDE9A
SCHEMBL5752454 0.72 P2RX7 (0.43) P2RX7
SCHEMBL5751442 0.71 PTGDR2 (0.48) P2RX7KMT2ASMN1; SMN2
SCHEMBL5753192 0.70 PDE5A (0.51) CCR2CCR5PDE5APDE9APDE1A
SCHEMBL5750623 0.70 CCR2 (0.36) CCR2CCR5ADCY10P2RX7KMT2A
SCHEMBL5750478 0.70 CCR2 (0.44) CCR2CCR5P2RX7

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
EP-1299361-B1 PYRAZOLE DERIVATIVES PFIZER LTD (GB) 2006-07-19 EP claimed
EP-1299361-A1 PYRAZOLE DERIVATIVES Pfizer Limited (GB) 2003-04-09 EP claimed
WO-2002004424-A9 PYRAZOLE DERIVATIVES PFIZER LTD (GB) 2002-12-12 WO claimed
US-20020032184-A1 Pyrazole derivatives PFIZER INC. 2002-03-14 US claimed
WO-2002004424-A1 PYRAZOLE DERIVATIVES PFIZER LIMITED (GB) 2002-01-17 WO claimed

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-20020032184-A1 Pyrazole derivatives POLRMT, TPMT, CYP3A43 CCR2 4197/4885CCR5 2111/4885ADCY10 4748/4885

“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.