SCHEMBL19072733

SCHEMBL19072733

Fc1cc(F)cc(-c2cc(F)ccn2)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 3/20 0.41
▸ NOTUM Q6P988 1/20 0.41
▸ KMO O15229 2/20 0.38
▸ CTDSP1 Q9GZU7 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ ASIC3 Q9UHC3 1/20 0.36
▸ IDO1 P14902 2/20 0.36
▸ MAPKAPK2 P49137 2/20 0.35
▸ NISCH Q9Y2I1 1/20 0.35
▸ TGFBR1 P36897 1/20 0.35
▸ TDO2 P48775 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
SCHEMBL810938 0.83 CCR1 (0.48) GRM5KMOIDO1TGFBR1
SCHEMBL31484870 0.83 CCR1 (0.48) GRM5KMOIDO1TGFBR1
SCHEMBL25118560 0.83 IDO1 (0.55) GRM5KMOIDO1MAPKAPK2NISCH
SCHEMBL19248539 0.81 CCR1 (0.61) GRM5
SCHEMBL5934924 0.80 ASIC3 (0.59) GRM5KMOCTDSP1ASIC3TGFBR1
SCHEMBL20469167 0.79 ASIC3 (0.40) ASIC3TGFBR1
SCHEMBL31168033 0.79 IDO1 (0.39) GRM5KMOIDO1TGFBR1
SCHEMBL15624430 0.79 CCR1 (0.41) GRM5KMOTDP1
SCHEMBL28731089 0.78 ASIC3 (0.57) GRM5KMOCTDSP1ASIC3TGFBR1
SCHEMBL19072769 0.78 TDP1 (0.43) KMOTDP1IDO1TGFBR1

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
US-9859511-B2 Organoiridium complex for organic electroluminescent elements TANAKA KIKINZOKU KOGYO K.K. (JP) 2018-01-02 — — US disclosed
US-20170237021-A1 ORGANIC IRIDIUM COMPLEX FOR ORGANIC ELECTROLUMINESCENT ELEMENTS TANAKA KIKINZOKU KOGYO K.K. (JP) 2017-08-17 — — US disclosed
US-20170237021-A1 ORGANIC IRIDIUM COMPLEX FOR ORGANIC ELECTROLUMINESCENT ELEMENTS TANAKA KIKINZOKU KOGYO K.K. (JP) 2017-08-17 — — US disclosed
EP-3187503-A1 ORGANIC IRIDIUM COMPLEX FOR ORGANIC ELECTROLUMINESCENT ELEMENTS Tanaka Kikinzoku Kogyo K.K. (JP) 2017-07-05 — — 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-20170237021-A1 ORGANIC IRIDIUM COMPLEX FOR ORGANIC ELECTROLUMINESCENT ELEMENTS L1CAM, ETFA, TTI2 GRM5 3368/4885NOTUM 1605/4885KMO 2882/4885

“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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