SCHEMBL20264488

SCHEMBL20264488

CCN1CCN(c2ncc(C(=O)O)cc2C(F)(F)F)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 1/20 0.44
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ SMN1; SMN2 Q16637 5/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ HSD11B1 P28845 2/20 0.41
▸ PPARG P37231 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ TSHR P16473 1/20 0.39
▸ TTR P02766 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HPGD P15428 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ CHRM4 P08173 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ GAA P10253 1/20 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
SCHEMBL3684029 0.81 KMT2A (0.46) MEN1KMT2ASMN1; SMN2MAPTHSD11B1
SCHEMBL3947541 0.81 POLB (0.55) SMN1; SMN2ALDH1A1MAPTHSD11B1TSHR
SCHEMBL20979579 0.81 CNR2 (0.42) RAF1MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL24215432 0.73 ABL1 (0.42) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL30411412 0.72 SMN1; SMN2 (0.52) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL24215470 0.72 SMN1; SMN2 (0.52) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL2313005 0.72 RET (0.51) MEN1KMT2AALDH1A1NPSR1HTT
Hydrochloric Acid SCHEMBL393146 0.71 RET (0.50) MEN1KMT2AALDH1A1NPSR1HTT
SCHEMBL1135082 0.70 CHRM4 (0.50) RAF1MAPTTTRCHRM4CHRM1
SCHEMBL30385080 0.70 KMT2A (0.41) MEN1KMT2ASMN1; SMN2MAPTCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3191478-B1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS NOVARTIS AG (CH) 2019-05-08 — — EP disclosed
US-10167279-B2 Compounds and compositions as RAF kinase inhibitors NOVARTIS AG (CH) 2019-01-01 — — US disclosed
US-10167279-B2 Compounds and compositions as RAF kinase inhibitors NOVARTIS AG (CH) 2019-01-01 — — US disclosed
US-20180170917-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2018-06-21 — — US disclosed
US-20180170917-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2018-06-21 — — US disclosed
US-20180170917-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS NOVARTIS VACCINES AND DIAGNOSTICS, INC. 2018-06-21 — — 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 (2 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-20180170917-A1 COMPOUNDS AND COMPOSITIONS AS RAF KINASE INHIBITORS BRAF, RAF1, ARAF RAF1 2/4885MEN1 1108/4885KMT2A 1639/4885
US-10167279-B2 Compounds and compositions as RAF kinase inhibitors BRAF, RAF1, ARAF RAF1 2/4885MEN1 1108/4885KMT2A 1639/4885

“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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