SCHEMBL2288286

SCHEMBL2288286

Cc1ccccc1Oc1ccc(Br)c(CBr)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.44
SLC6A4 P31645 4/20 0.43
SLC6A2 P23975 3/20 0.43
SLC6A3 Q01959 3/20 0.43
HTR2A P28223 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
ACHE P22303 3/20 0.39
PTGS2 P35354 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
TSHR P16473 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
FFAR1 O14842 1/20 0.38
GRIA2 P42262 1/20 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
SCHEMBL27778082 0.89 AR (0.43) ARSLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL2296290 0.83 FFAR4 (0.41) SLC6A4HTR2ASMN1; SMN2ALDH1A1CYP1A2
SCHEMBL2290093 0.81 FFAR1 (0.42) ARSLC6A4SLC6A2SLC6A3HTR2A
SCHEMBL2290424 0.81 PARP10 (0.42) SLC6A4SLC6A2SLC6A3HTR2ANR3C1
SCHEMBL2291189 0.78 LTA4H (0.44) SMN1; SMN2ALDH1A1MEN1TSHRKMT2A
SCHEMBL30440178 0.78 POLB (0.51) AR
SCHEMBL27778085 0.77 AR (0.43) ARSLC6A4HTR2ASMN1; SMN2ALDH1A1
SCHEMBL10817065 0.75 LPAR1 (0.49) ARSMN1; SMN2ALDH1A1CYP1A2CYP2C9
SCHEMBL2294122 0.73 SOS1 (0.41) SLC6A4HTR2AFFAR1MMP14
SCHEMBL2287390 0.73 LTA4H (0.44) SLC6A4SLC6A2SLC6A3HTR2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2149545-B1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL CO (JP) 2016-10-05 EP disclosed
US-7994367-B2 Method for producing benzaldehyde compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-09 US disclosed
US-20100210879-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-08-19 US disclosed
EP-2149545-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND Sumitomo Chemical Company, Limited (JP) 2010-02-03 EP 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-20100210879-A1 METHOD FOR PRODUCING BENZALDEHYDE COMPOUND NQO1, C9, TRPA1 AR 173/4885SLC6A4 1544/4885SLC6A2 3499/4885

“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.