SCHEMBL18361010

SCHEMBL18361010

FC(F)(F)c1ccc(-n2c3ccccc3c3ccccc32)c(-c2ccc(-c3cc(C(F)(F)F)ccc3-n3c4ccccc4c4ccccc43)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 4/20 0.50
▸ HSP90AA1 P07900 1/20 0.40
▸ METAP2 P50579 1/20 0.38
▸ GRM2 Q14416 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ PKM P14618 1/20 0.38
▸ ATM Q13315 2/20 0.37
▸ PPARG P37231 1/20 0.37
▸ PPARA Q07869 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ PTGDR2 Q9Y5Y4 2/20 0.37
▸ CYP1A1 P04798 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2E1 P05181 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C8 P10632 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2A6 P11509 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
SCHEMBL18360988 0.95 KIF11 (0.49) KIF11HSP90AA1METAP2ALDH1A1PKM
SCHEMBL18361132 0.92 KIF11 (0.54) KIF11HSP90AA1METAP2ALDH1A1PKM
SCHEMBL18361209 0.91 KIF11 (0.43) KIF11HSP90AA1METAP2GRM2ALDH1A1
SCHEMBL26496751 0.84 KIF11 (0.50) KIF11HSP90AA1ALDH1A1PKMPPARG
SCHEMBL18374580 0.84 KIF11 (0.47) KIF11HSP90AA1ALDH1A1PKMATM
SCHEMBL18361014 0.84 KIF11 (0.50) KIF11HSP90AA1ALDH1A1PKMATM
SCHEMBL20902640 0.83 KIF11 (0.41) KIF11METAP2ATMMEN1NPC1
SCHEMBL24370468 0.83 KIF11 (0.40) KIF11HSP90AA1PTGDR2
SCHEMBL18361017 0.82 KIF11 (0.46) KIF11HSP90AA1ALDH1A1PKMPPARG
SCHEMBL18361015 0.82 KIF11 (0.49) KIF11HSP90AA1ALDH1A1PKMPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10263196-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2019-04-16 — — US disclosed
EP-3138137-B1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-06-20 — — EP disclosed
US-20180026202-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-25 — — US disclosed
US-20180026202-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-25 — — US disclosed
WO-2017005699-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2017-01-12 — — WO disclosed
EP-3113239-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES cynora GmbH (DE) 2017-01-04 — — 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 (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-10263196-B2 Organic molecules for use in optoelectronic devices OR10J3, ORC3, OXER1 KIF11 4272/4885HSP90AA1 4841/4885METAP2 4340/4885
US-20180026202-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES ORC3, OR10J3, C1R KIF11 4250/4885HSP90AA1 4845/4885METAP2 4338/4885

“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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