SCHEMBL1975288

SCHEMBL1975288

CNCCc1cn(C)c2ccc(F)c(OCc3cccc(C(F)(F)F)c3)c12

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.47
CARM1 Q86X55 3/20 0.44
PRMT6 Q96LA8 3/20 0.44
MAOB P27338 8/20 0.40
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
MRGPRX4 Q96LA9 2/20 0.38
MAOA P21397 1/20 0.38
IDO1 P14902 2/20 0.38

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
SCHEMBL1164591 0.87 MAOB (0.46) ADRB2MAOBTHRATHRBMAOA
SCHEMBL1162963 0.87 TAAR1 (0.46) CARM1PRMT6MAOBTHRATHRB
SCHEMBL19650679 0.85 TAAR1 (0.40) CARM1PRMT6MAOBMAOA
SCHEMBL1163027 0.84 ADRB2 (0.49) ADRB2CARM1PRMT6THRB
SCHEMBL1164594 0.82 HTR2B (0.50) ADRB2MAOBTHRATHRBMAOA
SCHEMBL1163145 0.81 TAAR1 (0.42) ADRB2CARM1PRMT6MAOB
SCHEMBL1163099 0.81 CARM1 (0.43) ADRB2CARM1PRMT6MAOBMAOA
SCHEMBL1163355 0.80 CARM1 (0.35) ADRB2CARM1PRMT6THRATHRB
SCHEMBL1163258 0.80 TAAR1 (0.41) ADRB2CARM1PRMT6MAOBMAOA
SCHEMBL1163130 0.80 ADRB2 (0.37) ADRB2CARM1PRMT6MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF ELDER AMY (US) 2017-11-30 US disclosed
US-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF ELDER AMY (US) 2017-11-30 US disclosed
US-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF ELDER AMY (US) 2017-11-30 US disclosed
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 US disclosed
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 US disclosed
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION (US) 2015-10-08 US disclosed
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 US disclosed
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 US disclosed
US-8912220-B2 Compounds and methods of use thereof Galenea Pharmaceuticals 2014-12-16 US disclosed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 US disclosed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 US disclosed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 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-20170342054-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT ADRB2 613/4885CARM1 1702/4885PRMT6 996/4885
US-20150284365-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT ADRB2 613/4885CARM1 1702/4885PRMT6 996/4885
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT ADRB2 613/4885CARM1 1702/4885PRMT6 996/4885

“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.