SCHEMBL12241338

SCHEMBL12241338

Cc1ccccc1C(=O)Nc1cnc(-c2c(C(F)(F)F)sc3c2CCCC3)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.47
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ DCTPP1 Q9H773 1/20 0.44
▸ TP53 P04637 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ NPC1 O15118 4/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ FABP4 P15090 2/20 0.41
▸ FABP5 Q01469 2/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ ANO1 Q5XXA6 4/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ ANO2 Q9NQ90 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ POLB P06746 1/20 0.39

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
SCHEMBL12155967 0.98 MEN1 (0.48) FLT3MEN1KMT2ADCTPP1TP53
SCHEMBL12241337 0.91 SMN1; SMN2 (0.48) MEN1KMT2ATP53MAPTNPC1
SCHEMBL12155990 0.89 KMT2A (0.49) MEN1KMT2ATP53MAPTNPC1
SCHEMBL12241334 0.87 NPC1 (0.47) FLT3MEN1KMT2ADCTPP1TP53
SCHEMBL12241326 0.86 MEN1 (0.53) FLT3MEN1KMT2ADCTPP1TP53
SCHEMBL12155983 0.85 MEN1 (0.48) FLT3MEN1KMT2ADCTPP1TP53
SCHEMBL12155969 0.84 MEN1 (0.43) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL12155988 0.82 MEN1 (0.43) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL12241336 0.81 ALDH1A1 (0.41) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL12155955 0.81 IL2 (0.39) FABP4FABP5ALDH1A1LMNAANO1

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
US-20200317617-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM AVENUE CAPITAL MANAGEMENT II, L.P. 2020-10-08 — — US disclosed
US-10703722-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2020-07-07 — — US disclosed
EP-2563776-B1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA INC (US) 2016-06-08 — — EP disclosed
US-20150322012-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM AVENUE CAPITAL MANAGEMENT II, L.P. 2015-11-12 — — US disclosed
US-9120751-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2015-09-01 — — US disclosed
US-9120751-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2015-09-01 — — US disclosed
US-8980629-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2015-03-17 — — US disclosed
US-8980629-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2015-03-17 — — US disclosed
US-8546403-B2 Compounds that modulate intracellular calcium CALCIMEDICA, INC. (US) 2013-10-01 — — US disclosed
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-10-27 — — US disclosed
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2011-10-27 — — 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 (4 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-20150322012-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 FLT3 4565/4885MEN1 2958/4885KMT2A 4706/4885
US-10703722-B2 Compounds that modulate intracellular calcium ORAI1, SARAF, RYR2 FLT3 4565/4885MEN1 2958/4885KMT2A 4706/4885
US-20110263612-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 FLT3 4565/4885MEN1 2958/4885KMT2A 4706/4885
US-20200317617-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 FLT3 4565/4885MEN1 2958/4885KMT2A 4706/4885

“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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