SCHEMBL16428153

SCHEMBL16428153

COc1ccc([C@@H](C)N2C[C@H](C(O)C(F)S(=O)(=O)c3ccccc3)CC2=O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.42
▸ HSD17B2 P37059 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ MMP13 P45452 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ MMP2 P08253 5/20 0.36
▸ MMP3 P08254 4/20 0.36
▸ MMP1 P03956 3/20 0.36
▸ MMP9 P14780 3/20 0.36
▸ MMP7 P09237 2/20 0.36
▸ MMP8 P22894 2/20 0.36
▸ HSD11B1 P28845 1/20 0.36
▸ MAPT P10636 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ PDE4A P27815 3/20 0.34
▸ PDE4B Q07343 3/20 0.34

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
SCHEMBL19499071 0.83 SMN1; SMN2 (0.43) KMT2AHSD17B2SMN1; SMN2ALDH1A1NPC1
SCHEMBL16427649 0.83 SMN1; SMN2 (0.43) KMT2AHSD17B2SMN1; SMN2ALDH1A1NPC1
SCHEMBL19497982 0.81 KMT2A (0.43) KMT2AHSD17B2SMN1; SMN2MAPK1HSD11B1
SCHEMBL19499465 0.80 KMT2A (0.42) KMT2AHSD17B2SMN1; SMN2MAPK1MMP2
SCHEMBL16430035 0.79 ALDH1A1 (0.44) KMT2ASMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL19965134 0.78 SMN1; SMN2 (0.46) KMT2AHSD17B2SMN1; SMN2ALDH1A1NPC1
SCHEMBL18645260 0.78 SMN1; SMN2 (0.46) KMT2AHSD17B2SMN1; SMN2ALDH1A1NPC1
SCHEMBL16428059 0.78 SMN1; SMN2 (0.46) KMT2AHSD17B2SMN1; SMN2ALDH1A1NPC1
SCHEMBL16428060 0.78 SMN1; SMN2 (0.46) KMT2AHSD17B2SMN1; SMN2ALDH1A1NPC1
SCHEMBL17102255 0.78 SMN1; SMN2 (0.46) KMT2AHSD17B2SMN1; SMN2ALDH1A1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10005774-B2 Syk inhibitors GILEAD SCIENCES, INC. (US) 2018-06-26 — — US disclosed
US-10005774-B2 Syk inhibitors GILEAD SCIENCES, INC. (US) 2018-06-26 — — US disclosed
US-10005774-B2 Syk inhibitors GILEAD SCIENCES, INC. (US) 2018-06-26 — — US disclosed
EP-3027601-B1 SYK INHIBITORS GILEAD SCIENCES INC (US) 2017-10-25 — — EP disclosed
EP-3027601-B1 SYK INHIBITORS GILEAD SCIENCES INC (US) 2017-10-25 — — EP disclosed
US-20160368918-A1 SYK INHIBITORS Kronos Bio, Inc. 2016-12-22 — — US disclosed
US-20160368918-A1 SYK INHIBITORS Kronos Bio, Inc. 2016-12-22 — — US disclosed
US-20160368918-A1 SYK INHIBITORS Kronos Bio, Inc. 2016-12-22 — — US disclosed
US-9376441-B2 Substituted pyrrolidines as SYK inhibitors GILEAD SCIENCES, INC. (US) 2016-06-28 — — US disclosed
US-9376441-B2 Substituted pyrrolidines as SYK inhibitors GILEAD SCIENCES, INC. (US) 2016-06-28 — — US disclosed
US-9376441-B2 Substituted pyrrolidines as SYK inhibitors GILEAD SCIENCES, INC. (US) 2016-06-28 — — US disclosed
EP-3027601-A1 SYK INHIBITORS Gilead Sciences, Inc. (US) 2016-06-08 — — EP disclosed
WO-2015017610-A1 SYK INHIBITORS GILEAD SCIENCES, INC. (US) 2015-02-05 — — WO disclosed
WO-2015017610-A1 SYK INHIBITORS GILEAD SCIENCES, INC. (US) 2015-02-05 — — WO disclosed
US-20150038488-A1 SYK INHIBITORS Kronos Bio, Inc. 2015-02-05 — — US disclosed
US-20150038488-A1 SYK INHIBITORS Kronos Bio, Inc. 2015-02-05 — — US disclosed
US-20150038488-A1 SYK INHIBITORS Kronos Bio, Inc. 2015-02-05 — — 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 (3 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-20150038488-A1 SYK INHIBITORS SYK, BTK, LYN KMT2A 850/4885HSD17B2 4630/4885SMN1; SMN2 3200/4885
US-20160368918-A1 SYK INHIBITORS SYK, BTK, LYN KMT2A 930/4885HSD17B2 4642/4885SMN1; SMN2 3271/4885
US-10005774-B2 Syk inhibitors SYK, BTK, LYN KMT2A 930/4885HSD17B2 4642/4885SMN1; SMN2 3271/4885

“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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