SCHEMBL1573101

SCHEMBL1573101

C=C(c1ncc[nH]1)c1ccc(OC)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYK2 P29597 2/20 0.43
JAK2 O60674 1/20 0.43
ADRA2A P08913 1/20 0.40
ADRA2C P18825 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
KMT2A Q03164 2/20 0.40
BRAF P15056 1/20 0.39
HDAC1 Q13547 1/20 0.39
FLT1 P17948 1/20 0.36
FLT4 P35916 1/20 0.36
KDR P35968 1/20 0.36
RAB9A P51151 3/20 0.36
MAPT P10636 3/20 0.36
LMNA P02545 2/20 0.35
HPGDS O60760 1/20 0.35
SMPD3 Q9NY59 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TLK2 Q86UE8 2/20 0.34

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
SCHEMBL697121 0.89 TYK2 (0.43) TYK2JAK2ADRA2AADRA2CADRA1D
SCHEMBL697561 0.81 KMT2A (0.44) TYK2JAK2KMT2ARAB9AMAPT
SCHEMBL697273 0.77 KMT2A (0.50) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL702086 0.73 KMT2A (0.46) JAK2ADRA2AADRA2CADRA1DADRA1A
SCHEMBL698190 0.73 KMT2A (0.52) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL697991 0.73 CYP1A2 (0.41) KMT2ABRAFHDAC1RAB9AMAPT
SCHEMBL705111 0.73 KMT2A (0.48) TYK2JAK2KMT2ARAB9AMAPT
SCHEMBL697082 0.71 SMPD3 (0.38) ADRA2AADRA2CADRA1DADRA1AADRA1B
SCHEMBL9500830 0.71 NPC1 (0.56) KMT2ABRAFHDAC1RAB9AMAPT
SCHEMBL23268318 0.71 JAK2 (0.48) TYK2JAK2FLT1FLT4KDR

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP disclosed
US-7825149-B2 Substituted imidazoles PFIZER LIMITED (GB) 2010-11-02 US disclosed
US-20090312326-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2009-12-17 US disclosed
US-7592362-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-09-22 US disclosed
US-7547718-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-16 US disclosed
US-7544706-B2 Substituted imidazoles PFIZER LIMITED (GB) 2009-06-09 US disclosed
US-20080125473-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-29 US disclosed
US-20080119536-A1 SUBSTITUTED IMIDAZOLES PFIZER LIMITED (GB) 2008-05-22 US disclosed
US-20070167506-A1 SUBSTITUTED IMIDAZOLES PFIZER INC. (US) 2007-07-19 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 (4 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-20080125473-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TYK2 693/4885JAK2 453/4885ADRA2A 456/4885
US-20090312326-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TYK2 693/4885JAK2 453/4885ADRA2A 456/4885
US-20070167506-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TYK2 693/4885JAK2 453/4885ADRA2A 456/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 TYK2 693/4885JAK2 453/4885ADRA2A 456/4885

“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.