SCHEMBL10000607

SCHEMBL10000607

Cc1cc2ccccc2cc1-c1ncc2cccnc2c1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.42
CCR8 P51685 3/20 0.42
DHODH Q02127 8/20 0.41
FEN1 P39748 1/20 0.39
CCR5 P51681 2/20 0.38
ALDH1A1 P00352 5/20 0.37
LMNA P02545 1/20 0.37
ALOX12 P18054 1/20 0.37
LDHA P00338 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 1/20 0.35
CASP3 P42574 1/20 0.35
RAB9A P51151 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35

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
SCHEMBL16975587 0.84 KDM4E (0.45) FEN1ALDH1A1LMNANPC1RAB9A
SCHEMBL10000603 0.75 CCR1 (0.43) CCR1CCR8CCR5LMNAL3MBTL1
SCHEMBL10000615 0.72 MYC (0.38) CCR1CCR8ALDH1A1LMNALDHA
SCHEMBL11430231 0.71 LMNA (0.56) CCR1CCR8CCR5ALDH1A1LMNA
SCHEMBL10000555 0.69 KMT2A (0.45) DHODHALDH1A1LDHANPC1
SCHEMBL23678009 0.66 PARP1 (0.50) CCR1CCR8CCR5ALDH1A1LMNA
SCHEMBL10027750 0.66 PDGFRB (0.44) CCR1CCR8CCR5ALDH1A1LMNA
SCHEMBL10464782 0.65 ALDH1A1 (0.54) CCR1CCR8CCR5ALDH1A1LMNA
SCHEMBL17263288 0.65 JAK3 (0.45) CCR1CCR8ALDH1A1ALOX12NPC1
SCHEMBL17263277 0.65 CYP2A6 (0.41) CCR1CCR8CCR5ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2015-11-26 US disclosed
US-9096529-B2 Metal complex compound and organic light emitting diode device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-08-04 US disclosed
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-01-19 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 (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-20150340628-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 CCR1 1451/4885CCR8 3158/4885DHODH 2065/4885
US-20120012824-A1 METAL COMPLEX COMPOUND AND ORGANIC LIGHT EMITTING DIODE DEVICE INCLUDING THE SAME AP1M1, MT-CO1, AP2M1 CCR1 1451/4885CCR8 3158/4885DHODH 2065/4885

“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.