SCHEMBL8932626

SCHEMBL8932626

CCOc1ccc(-c2ccc(-c3ccc(Br)cc3F)cc2)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ ALOX5AP P20292 1/20 0.41
▸ FEN1 P39748 1/20 0.41
▸ RAB9A P51151 2/20 0.39
▸ FGFR2 P21802 2/20 0.39
▸ FGFR1 P11362 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MMP1 P03956 1/20 0.38
▸ MMP2 P08253 1/20 0.38
▸ MMP3 P08254 1/20 0.38
▸ MMP7 P09237 1/20 0.38
▸ MMP9 P14780 1/20 0.38
▸ MMP13 P45452 1/20 0.38
▸ KMT2A Q03164 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ MEN1 O00255 2/20 0.36

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
SCHEMBL18718210 0.89 TSHR (0.44) HPGDTSHRRAB9AFGFR2ALDH1A1
SCHEMBL1242253 0.89 FGFR2 (0.40) HPGDTSHRRAB9AFGFR2FGFR1
SCHEMBL8616112 0.82 USP28 (0.45) RAB9AALDH1A1LMNASMN1; SMN2HTT
SCHEMBL17791124 0.82 FGFR2 (0.41) HPGDALOX5APFEN1RAB9AFGFR2
SCHEMBL10303329 0.82 FGFR2 (0.39) HPGDFGFR2FGFR1ALDH1A1KMT2A
SCHEMBL21609904 0.82 FGFR2 (0.44) HPGDTSHRALOX5APFEN1RAB9A
SCHEMBL17791126 0.81 FGFR2 (0.41) HPGDALOX5APFEN1FGFR2FGFR1
SCHEMBL18718209 0.81 FGFR2 (0.42) HPGDFGFR2FGFR1ALDH1A1KMT2A
SCHEMBL10303371 0.80 GABRA1 (0.43) RAB9AFGFR2FGFR1SMN1; SMN2HSD17B10
SCHEMBL16855917 0.80 FGFR2 (0.46) HPGDFGFR2FGFR1ALDH1A1KMT2A

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-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 — — US disclosed
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 — — US disclosed
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-09 — — US disclosed
US-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2010-12-09 — — 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-20100309402-A1 FOUR- OR FIVE-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE KIF23, HCN3, FZD7 HPGD 4487/4885TSHR 3244/4885ALOX5AP 1414/4885

“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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