SCHEMBL4611142

SCHEMBL4611142

CC(C)C(=O)Nc1cccc(CN)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
LMNA P02545 1/20 0.56
TP53 P04637 2/20 0.52
TSHR P16473 2/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
PARP1 P09874 1/20 0.52
ALDH1A1 P00352 2/20 0.50
F2R P25116 1/20 0.50
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CFD P00746 1/20 0.50
HTT P42858 1/20 0.48
LOXL2 Q9Y4K0 1/20 0.47

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
SCHEMBL28325560 0.86 HSD17B10 (0.52) TP53TSHRMAPTCFD
SCHEMBL13469124 0.85 MAPT (0.59) SMN1; SMN2LMNATP53NPC1RAB9A
SCHEMBL6110283 0.84 SMN1; SMN2 (0.56) SMN1; SMN2LMNATP53TSHRNPC1
SCHEMBL2642980 0.83 CA12 (0.57) SMN1; SMN2RAB9AALDH1A1MEN1MAPT
SCHEMBL25144628 0.83 SMN1; SMN2 (0.55) SMN1; SMN2LMNATP53TSHRNPC1
SCHEMBL2545099 0.81 ALDH1A1 (0.61) SMN1; SMN2TSHRRAB9AALDH1A1MEN1
SCHEMBL5002993 0.81 SMN1; SMN2 (0.56) SMN1; SMN2LMNATSHRNPC1RAB9A
SCHEMBL26785129 0.81 SMN1; SMN2 (0.61) SMN1; SMN2LMNATP53TSHRNPC1
SCHEMBL2474191 0.81 SMN1; SMN2 (0.54) SMN1; SMN2LMNATP53TSHRNPC1
SCHEMBL27711792 0.80 HPGD (0.62) SMN1; SMN2TSHRNPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2496591-B1 ORGANOMETALLIC COMPLEX, LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2018-05-30 EP disclosed
US-7456195-B2 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed
US-7456195-B2 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed
EP-1910298-A2 PHENYLGLYCINAMIDE AND PYRIDYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS Brystol-Myers Squibb Company (US) 2008-04-16 EP disclosed
WO-2007002313-A2 PHENYLGLYCINAMIDE AND PYRIDYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 WO disclosed
US-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 US disclosed
US-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 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 (1 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-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants F12, F11, F7 SMN1; SMN2 4597/4885LMNA 292/4885TP53 3412/4885

“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.