SCHEMBL697287

SCHEMBL697287

Cc1cccc(C(C)c2nccn2C(C)(OC(=O)OC(C)(C2CC2)n2ccnc2C(C)c2cccc(C)c2C)C2CC2)c1C

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.35
LMNA P02545 7/20 0.34
TSHR P16473 6/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 5/20 0.34
RAB9A P51151 1/20 0.34
MAPT P10636 5/20 0.33
KMT2A Q03164 5/20 0.33
MEN1 O00255 3/20 0.33
NPSR1 Q6W5P4 3/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
ALOX15 P16050 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPK1 P28482 1/20 0.31
SSTR4 P31391 2/20 0.31
GRIN2B Q13224 1/20 0.31

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
SCHEMBL697288 0.93 NPC1 (0.34) NPC1LMNATSHRSMN1; SMN2L3MBTL1
SCHEMBL1573430 0.79 ADRA2A (0.35) NPC1LMNATSHRSMN1; SMN2L3MBTL1
SCHEMBL1573272 0.75 TP53 (0.33) NPC1LMNATSHRSMN1; SMN2ALDH1A1
SCHEMBL1573397 0.73 TP53 (0.32) NPC1LMNATSHRSMN1; SMN2ALDH1A1
SCHEMBL1573150 0.72 CNR1 (0.34) NPC1LMNAMAPTKMT2AGRIN2B
SCHEMBL697071 0.72 KDM4E (0.32) LMNATSHRALDH1A1RAB9AKMT2A
SCHEMBL3534000 0.71 CYP19A1 (0.39) TSHRKDM4E
SCHEMBL697473 0.71 ATM (0.36) TSHR
SCHEMBL697289 0.71 TP53 (0.33) NPC1LMNATSHRALDH1A1MAPT
SCHEMBL697567 0.71 SSTR4 (0.33) LMNATSHRALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP claimed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP claimed
EP-2423199-A1 Substituted imidazoles and their use as pesticides Pfizer Limited (GB) 2012-02-29 EP disclosed
EP-1981853-B1 SUBSTITUTED IMIDAZOLES AND THEIR USE AS PESTICIDES PFIZER LTD (GB) 2011-04-13 EP 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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 NPC1 745/4885LMNA 3030/4885TSHR 3443/4885
US-20080119536-A1 SUBSTITUTED IMIDAZOLES ABL1, TYR, CYP3A4 NPC1 745/4885LMNA 3030/4885TSHR 3443/4885

“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.