SCHEMBL12737598

SCHEMBL12737598

C/C=C/C1CCC(c2ccc(C(=O)OC3CCC(c4ccc(OCC)c(F)c4F)CC3)c(F)c2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ CAMKK1 Q8N5S9 1/20 0.32
▸ CAMKK2 Q96RR4 1/20 0.32
▸ MRGPRX1 Q96LB2 3/20 0.31
▸ TSPO P30536 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ PTGDR2 Q9Y5Y4 2/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ ACACB O00763 1/20 0.30

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
SCHEMBL12741059 1.00 MAPT (0.35) MAPTSMN1; SMN2CAMKK1CAMKK2MRGPRX1
SCHEMBL12737642 0.91 KDM1A (0.37) MAPTSMN1; SMN2CAMKK1CAMKK2
SCHEMBL14922550 0.90 MAPT (0.40) MAPTSMN1; SMN2CAMKK1CAMKK2MRGPRX1
SCHEMBL12737597 0.89 MAPT (0.35) MAPTSMN1; SMN2CAMKK1CAMKK2MRGPRX1
SCHEMBL12741058 0.89 MAPT (0.35) MAPTSMN1; SMN2CAMKK1CAMKK2MRGPRX1
SCHEMBL12737685 0.88 CPS1 (0.36) CAMKK1CAMKK2ACACB
SCHEMBL12737601 0.86 MAPT (0.37) MAPTSMN1; SMN2CAMKK1CAMKK2MRGPRX1
SCHEMBL14767243 0.86 MAPT (0.37) MAPTSMN1; SMN2CAMKK1CAMKK2MRGPRX1
SCHEMBL12822542 0.86 SMN1; SMN2 (0.37) MAPTSMN1; SMN2CAMKK1CAMKK2MRGPRX1
SCHEMBL15381579 0.86 MAPT (0.37) MAPTSMN1; SMN2CAMKK1CAMKK2MRGPRX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 — — US disclosed
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 — — US disclosed
US-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2011-04-21 — — 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-20110090450-A1 FOUR-RING LIQUID CRYSTAL COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE LEF1, LAS1L, EFHD2 MAPT 1075/4885SMN1; SMN2 3745/4885CAMKK1 1995/4885

“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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