SCHEMBL1817958

SCHEMBL1817958

CCCCCc1ccc(-c2cccc(F)c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 3/20 0.63
▸ RARB P10826 8/20 0.55
▸ RARA P10276 2/20 0.55
▸ RARG P13631 1/20 0.55
▸ CYP17A1 P05093 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP11B1 P15538 1/20 0.51
▸ CYP11B2 P19099 1/20 0.51
▸ HSD11B1 P28845 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ ESR2 Q92731 1/20 0.49
▸ MGLL Q99685 1/20 0.48
▸ MEN1 O00255 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ MAPT P10636 1/20 0.47
▸ MTOR P42345 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ GCGR P47871 1/20 0.46
▸ LPL P06858 1/20 0.46

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
SCHEMBL7786181 0.98 TAAR1 (0.61) TAAR1RARBRARARARGCYP17A1
SCHEMBL28632619 0.95 TAAR1 (0.65) TAAR1RARBRARARARGCYP17A1
SCHEMBL502723 0.90 TAAR1 (0.56) TAAR1RARBRARARARGCYP17A1
SCHEMBL3172512 0.90 TAAR1 (0.51) TAAR1RARBRARARARGCYP17A1
SCHEMBL3158297 0.88 TAAR1 (0.50) TAAR1RARBRARARARGCYP17A1
SCHEMBL3172767 0.88 TAAR1 (0.50) TAAR1RARBRARARARGCYP17A1
SCHEMBL502700 0.88 TAAR1 (0.69) TAAR1CYP17A1CYP3A4CYP11B1CYP11B2
SCHEMBL3159318 0.88 TAAR1 (0.49) TAAR1RARBRARARARGCYP17A1
SCHEMBL3158490 0.86 TAAR1 (0.48) TAAR1RARBRARARARGCYP17A1
SCHEMBL3168333 0.86 TAAR1 (0.48) TAAR1RARBRARARARGCYP17A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118307575-B Synthesis method of 4' -alkyl-3-fluoro-4-biphenylboronic acid 山东盛华电子新材料有限公司 2024-08-02 — — CN claimed
CN-118307575-A Synthesis method of 4' -alkyl-3-fluoro-4-biphenylboronic acid 山东盛华电子新材料有限公司 2024-07-09 — — CN claimed
CN-118307575-B Synthesis method of 4' -alkyl-3-fluoro-4-biphenylboronic acid 山东盛华电子新材料有限公司 2024-08-02 — — CN disclosed
CN-118307575-A Synthesis method of 4' -alkyl-3-fluoro-4-biphenylboronic acid 山东盛华电子新材料有限公司 2024-07-09 — — CN disclosed
CN-106132915-A Method for producing compound having oxydifluoromethylene skeleton 大金工业株式会社 2016-11-16 — — CN disclosed
EP-2116522-B1 PENTACYCLIC LIQUID CRYSTAL COMPOUND HAVING CF<SB>2</SB>O BONDING GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY JNC CORP (JP) 2013-09-18 — — EP disclosed
US-7951433-B2 Five-ring liquid crystal compound having CF2O bonding group, liquid crystal composition, and liquid crystal display device CHISSO CORPORATION (JP) 2011-05-31 — — US disclosed
US-7951433-B2 Five-ring liquid crystal compound having CF2O bonding group, liquid crystal composition, and liquid crystal display device CHISSO CORPORATION (JP) 2011-05-31 — — US disclosed
US-20100127211-A1 FIVE-RING LIQUID CRYSTAL COMPOUND HAVING CF20 BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-05-27 — — US disclosed
US-20100127211-A1 FIVE-RING LIQUID CRYSTAL COMPOUND HAVING CF20 BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-05-27 — — US disclosed
EP-2116522-A1 PENTACYCLIC LIQUID CRYSTAL COMPOUND HAVING CF<SB>2</SB>O BONDING GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY Chisso Corporation (JP) 2009-11-11 — — 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-20100127211-A1 FIVE-RING LIQUID CRYSTAL COMPOUND HAVING CF20 BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CFAP20, KIF20A, KIF20B TAAR1 3234/4885RARB 2364/4885RARA 1623/4885

“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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