SCHEMBL14445629

SCHEMBL14445629

CC(C)c1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 3/20 0.73
▸ LMNA P02545 1/20 0.70
▸ P2RX1 P51575 1/20 0.66
▸ RAB9A P51151 3/20 0.65
▸ NPC1 O15118 2/20 0.65
▸ CASP3 P42574 1/20 0.65
▸ SMN1; SMN2 Q16637 1/20 0.65
▸ SENP8 Q96LD8 1/20 0.65
▸ SENP7 Q9BQF6 1/20 0.65
▸ SENP6 Q9GZR1 1/20 0.65
▸ MEN1 O00255 1/20 0.64
▸ HTT P42858 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ MAPT P10636 1/20 0.63
▸ KCNK3 O14649 2/20 0.63
▸ KCNK9 Q9NPC2 1/20 0.62
▸ NPSR1 Q6W5P4 1/20 0.62
▸ KCNQ3 O43525 2/20 0.62
▸ KCNQ2 O43526 2/20 0.62
▸ KCNE1 P15382 2/20 0.62

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
SCHEMBL14445617 0.88 MAPT (0.70) PTGS1LMNAP2RX1RAB9AMEN1
SCHEMBL8363755 0.85 MEN1 (0.77) PTGS1LMNAP2RX1RAB9ASMN1; SMN2
SCHEMBL5131380 0.85 RHOC (0.80) PTGS1LMNAP2RX1RAB9ANPC1
SCHEMBL3454009 0.85 PTGS1 (1.00) PTGS1LMNAP2RX1RAB9ANPC1
SCHEMBL14445616 0.84 CSF1R (0.61) PTGS1LMNAP2RX1RAB9AMEN1
SCHEMBL28668959 0.83 LMNA (0.83) PTGS1LMNAP2RX1RAB9ANPC1
SCHEMBL30739967 0.83 LMNA (0.78) PTGS1LMNAP2RX1RAB9ANPC1
SCHEMBL23844170 0.83 NPC1 (0.76) LMNARAB9ANPC1CASP3SMN1; SMN2
SCHEMBL4517587 0.83 LMNA (1.00) PTGS1LMNAP2RX1RAB9ANPC1
SCHEMBL30739929 0.83 LMNA (1.00) PTGS1LMNAP2RX1RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9321766-B1 Kinase inhibitors ALLERGAN, INC. (US) 2016-04-26 — — US disclosed
US-20160096832-A1 KINASE INHIBITORS ALLERGAN, INC. 2016-04-07 — — US disclosed
US-20070161645-A1 Thiazole inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-07-12 — — US disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 — — US disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 — — 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-20070161645-A1 Thiazole inhibitors targeting resistant kinase mutations JAK2, ABL1, FLT3 PTGS1 2024/4885LMNA 2025/4885P2RX1 4186/4885
US-20160096832-A1 KINASE INHIBITORS ABL1, LCK, ERBB2 PTGS1 1317/4885LMNA 4604/4885P2RX1 2952/4885
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations ABL1, KDR, BCR PTGS1 2118/4885LMNA 1837/4885P2RX1 4518/4885

“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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