SCHEMBL1975293

SCHEMBL1975293

CC(C)[C@@]1(c2ccc(F)cc2)C[C@@]12C(=O)Nc1ccc(F)cc12

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.45
MAPT P10636 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
AKR1B1 P15121 3/20 0.38
BRD4 O60885 2/20 0.38
HTR7 P34969 1/20 0.36
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
BCHE P06276 3/20 0.35
ACHE P22303 3/20 0.35
SNRNP200 O75643 2/20 0.35
PGR P06401 1/20 0.34
RAB9A P51151 1/20 0.34
PLK4 O00444 2/20 0.34
AURKB Q96GD4 2/20 0.34
NPSR1 Q6W5P4 1/20 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
SCHEMBL16477251 0.93 CYP1A2 (0.41) CYP1A2MAPTCYP2C19KMT2AAKR1B1
SCHEMBL1971288 0.93 CYP1A2 (0.41) CYP1A2MAPTCYP2C19KMT2AAKR1B1
SCHEMBL12554824 0.93 CYP1A2 (0.41) CYP1A2MAPTCYP2C19KMT2AAKR1B1
SCHEMBL1974580 0.93 CYP1A2 (0.41) CYP1A2MAPTCYP2C19KMT2AAKR1B1
SCHEMBL1971416 0.93 CYP1A2 (0.41) CYP1A2MAPTCYP2C19KMT2AAKR1B1
SCHEMBL1975512 0.87 MAPK1 (0.40) MAPTKMT2AHTR7SMN1; SMN2NPSR1
SCHEMBL1973774 0.79 LMNA (0.38) CYP1A2MAPTCYP2C19KMT2AHTR7
SCHEMBL1966160 0.77 CYP1A2 (0.54) CYP1A2MAPTCYP2C19KMT2AAKR1B1
SCHEMBL1975536 0.74 MAPK1 (0.40) MAPTKMT2AHTR7SMN1; SMN2NPSR1
SCHEMBL1973820 0.74 MAPK1 (0.40) MAPTKMT2AHTR7SMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130102604-A1 NOVEL CYCLOPROPANE INDOLINONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2013-04-25 US disclosed
US-8354443-B2 Cyclopropane indolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2013-01-15 US disclosed
US-20110144106-A1 NOVEL CYCLOPROPANE INDOLINONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 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 (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-20110144106-A1 NOVEL CYCLOPROPANE INDOLINONE DERIVATIVES GPR119, CPT1A, IRS1 CYP1A2 163/4885MAPT 3298/4885CYP2C19 748/4885
US-20130102604-A1 NOVEL CYCLOPROPANE INDOLINONE DERIVATIVES GPR119, CPT1A, IRS1 CYP1A2 157/4885MAPT 3247/4885CYP2C19 730/4885

“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.