SCHEMBL16340083

SCHEMBL16340083

Cc1cc2c(cc1-c1ccc(NC(=O)c3ccccc3F)cc1)OC1(CCC1)CC2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ IL2 P60568 2/20 0.43
▸ RAF1 P04049 2/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ SMN1; SMN2 Q16637 6/20 0.42
▸ NPC1 O15118 7/20 0.42
▸ RAB9A P51151 7/20 0.42
▸ TP53 P04637 4/20 0.42
▸ HPGD P15428 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ NFKB1 P19838 2/20 0.42
▸ NFKB2 Q00653 2/20 0.42
▸ RELA Q04206 2/20 0.42
▸ PTPRC P08575 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL16339787 0.90 IL2 (0.53) IL2RAF1KCNH2SMN1; SMN2NPC1
SCHEMBL16339606 0.88 IL2 (0.49) IL2RAF1KCNH2SMN1; SMN2NPC1
SCHEMBL17762912 0.87 IL2 (0.56) IL2RAF1KCNH2SMN1; SMN2NPC1
SCHEMBL16339225 0.86 IL2 (0.53) IL2RAF1KCNH2SMN1; SMN2NPC1
SCHEMBL17746852 0.86 IL2 (0.47) MAPTIL2RAF1KCNH2SMN1; SMN2
SCHEMBL17746854 0.83 RAF1 (0.42) KMT2AIL2RAF1KCNH2HPGD
SCHEMBL16381688 0.82 IL2 (0.50) IL2RAF1KCNH2SMN1; SMN2NPC1
SCHEMBL16381734 0.81 IL2 (0.49) IL2RAF1KCNH2TRPM8
Hydrochloric Acid SCHEMBL16334767 0.81 IL2 (0.49) IL2RAF1KCNH2SMN1; SMN2NPC1
SCHEMBL16381670 0.80 IL2 (0.51) MEN1KMT2AIL2RAF1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9790231-B2 Chromane and chromene derivatives and their use as CRAC modulators LUPIN LIMITED (IN) 2017-10-17 — — US claimed
US-20160137659-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS LUPIN LIMITED (IN) 2016-05-19 — — US claimed
EP-3013810-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS Lupin Limited (IN) 2016-05-04 — — EP claimed
WO-2014207648-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS LUPIN LIMITED (IN) 2014-12-31 — — WO claimed
US-9790231-B2 Chromane and chromene derivatives and their use as CRAC modulators LUPIN LIMITED (IN) 2017-10-17 — — US disclosed
US-9790231-B2 Chromane and chromene derivatives and their use as CRAC modulators LUPIN LIMITED (IN) 2017-10-17 — — US disclosed
US-20160137659-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS LUPIN LIMITED (IN) 2016-05-19 — — US disclosed
US-20160137659-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS LUPIN LIMITED (IN) 2016-05-19 — — US disclosed
US-20160137659-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS LUPIN LIMITED (IN) 2016-05-19 — — 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-20160137659-A1 CHROMANE AND CHROMENE DERIVATIVES AND THEIR USE AS CRAC MODULATORS ORAI1, RYR2, RYR1 MAPT 2512/4885MEN1 1894/4885KMT2A 4471/4885

“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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