SCHEMBL3268910

SCHEMBL3268910

COC(=O)c1cc(OCc2ccccc2)c2nc(C)n(C(=O)OC(C)(C)C)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.45
LMNA P02545 2/20 0.45
TRPV3 Q8NET8 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
TLR9 Q9NR96 4/20 0.40
TLR7 Q9NYK1 2/20 0.40
SMPD1 P17405 1/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
MAPT P10636 3/20 0.39
PPIA P62937 1/20 0.39
CYP2C9 P11712 2/20 0.39
PTGER1 P34995 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
NR1H2 P55055 2/20 0.38

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
SCHEMBL3267227 0.88 BRD4 (0.45) HPGDTRPV3SMN1; SMN2RAB9ANPC1
SCHEMBL5901935 0.83 HPGD (0.51) HPGDLMNASMN1; SMN2RAB9ANPC1
SCHEMBL20482349 0.79 DHODH (0.47) NR1H2
SCHEMBL3273621 0.78 KDM4E (0.41) HPGDLMNATLR7NR1H2L3MBTL1
SCHEMBL5901336 0.74 PPIA (0.47) HPGDSMN1; SMN2RAB9ANPC1MAPT
SCHEMBL16015342 0.72 LMNA (0.67) HPGDLMNASMN1; SMN2RAB9ANPC1
SCHEMBL2874673 0.71 SRD5A1 (0.41) HPGDLMNATRPV3SMN1; SMN2RAB9A
SCHEMBL3273708 0.71 DHODH (0.54) HPGDLMNASMN1; SMN2RAB9ANPC1
SCHEMBL19667370 0.70 ESR2 (0.48) HPGDLMNATLR9TLR7HDAC1
SCHEMBL23374108 0.70 LMNA (0.48) HPGDLMNASMPD1HDAC1HDAC8

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-1963311-B1 CHROMANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS RAQUALIA PHARMA INC (JP) 2010-06-16 EP disclosed
US-7723321-B2 Chromane substituted benzimidazole derivatives RAQUALIA PHARMA INC. (JP) 2010-05-25 US disclosed
EP-1963311-A1 CHROMANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS Pfizer, Inc. (US) 2008-09-03 EP disclosed
WO-2007072146-A1 CHROMANE SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS ACID PUMP INHIBITORS PFIZER JAPAN INC. (JP) 2007-06-28 WO disclosed
US-20070142448-A1 Chromane Substituted Benzimidazole Derivatives PFIZER INC. 2007-06-21 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 (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-20070142448-A1 Chromane Substituted Benzimidazole Derivatives HRH2, HRH4, HRH1 HPGD 942/4885LMNA 4581/4885TRPV3 283/4885

“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.