SCHEMBL14849671

SCHEMBL14849671

CC#Cc1ccc(C#Cc2ccnc(-c3cc(C#Cc4ccc(C#CC)s4)ccn3)c2)s1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ASIC3 Q9UHC3 1/20 0.35
▸ CCR1 P32246 2/20 0.34
▸ CCR5 P51681 2/20 0.34
▸ CCR8 P51685 2/20 0.34
▸ FFAR1 O14842 2/20 0.33
▸ BACE1 P56817 2/20 0.32

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
SCHEMBL18677577 0.85 FFAR1 (0.43) FFAR1
SCHEMBL23665545 0.74 CCR1 (0.63) ASIC3CCR1CCR5CCR8FFAR1
SCHEMBL12013266 0.73 DPP4 (0.42) —
SCHEMBL14849676 0.72 HSD17B1 (0.39) CCR1CCR5CCR8
SCHEMBL14849683 0.72 ALOX5 (0.32) CCR1CCR5CCR8
SCHEMBL14849678 0.71 KDM1A (0.37) CCR1CCR5CCR8
SCHEMBL18674452 0.70 NOS3 (0.33) FFAR1
SCHEMBL18121146 0.70 ASIC3 (0.42) ASIC3CCR1CCR5CCR8FFAR1
SCHEMBL18674370 0.70 FFAR1 (0.43) FFAR1
SCHEMBL18678731 0.69 KDM5B (0.48) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8574463-B2 Metal complex dye, photoelectric conversion element and dye-sensitized solar cell FUJIFILM CORPORATION (JP) 2013-11-05 — — US disclosed
US-20130087203-A1 METAL COMPLEX DYE, PHOTOELECTRIC CONVERSION ELEMENT AND DYE-SENSITIZED SOLAR CELL FUJIFILM CORPORATION (JP) 2013-04-11 — — 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-20130087203-A1 METAL COMPLEX DYE, PHOTOELECTRIC CONVERSION ELEMENT AND DYE-SENSITIZED SOLAR CELL L1CAM, LSG1, CRY1 ASIC3 795/4885CCR1 903/4885CCR5 4011/4885

“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.

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