SCHEMBL555886

SCHEMBL555886

CC(C)(C)c1ccc(NC(=O)c2ccc(C3OCC4(CO3)COC(c3ccc(C(=O)Nc5ccc(C(C)(C)C)cc5C(C)(C)C)cc3)OC4)cc2)c(C(C)(C)C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.53
SMN1; SMN2 Q16637 4/20 0.41
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
ALDH1A1 P00352 4/20 0.41
HTT P42858 3/20 0.41
LMNA P02545 3/20 0.41
MAPT P10636 3/20 0.41
DHODH Q02127 2/20 0.41
HPGD P15428 2/20 0.41
SERPINE1 P05121 1/20 0.41
DHPS P49366 1/20 0.41
MAPK1 P28482 2/20 0.40
GLA P06280 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
NR1H4 Q96RI1 1/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL516983 0.83 HDAC3 (0.56) CYP2C9SMN1; SMN2RAB9ANPC1LMNA
SCHEMBL9994871 0.81 CYP2C9 (0.43) CYP2C9SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL8460893 0.77 CYP2C9 (0.60) CYP2C9RAB9ANPC1ALDH1A1HTT
SCHEMBL517354 0.72 MAOA (0.56) RAB9ANPC1HDAC3HDAC8HDAC6
SCHEMBL517322 0.70 NPC1 (0.59) CYP2C9SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL516878 0.69 HPGD (0.50) SMN1; SMN2RAB9ANPC1ALDH1A1HTT
SCHEMBL10762782 0.69 CYP2C9 (0.50) CYP2C9RAB9ANPC1ALDH1A1HTT
SCHEMBL7223016 0.69 CYP2C9 (0.50) CYP2C9SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL517294 0.69 RAB9A (0.43) SMN1; SMN2RAB9ANPC1MAPTHPGD
SCHEMBL517016 0.68 L3MBTL1 (0.57) SMN1; SMN2RAB9ANPC1ALDH1A1LMNA

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-9023921-B2 Method for inhibiting crystal growth rate of amide compound and method for producing molded article of polyolefin-based resin NEW JAPAN CHEMICAL CO., LTD. (JP) 2015-05-05 US disclosed
US-8592071-B2 Laminated porous film and separator for battery MITSUBISHI PLASTICS, INC. (JP) 2013-11-26 US disclosed
EP-2431415-A1 METHOD FOR CONTROLLING CRYSTAL GROWTH RATE OF AMIDE COMPOUND AND METHOD FOR PRODUCING MOLDED ARTICLE OF POLYOLEFIN-BASED RESIN New Japan Chemical Co., Ltd. (JP) 2012-03-21 EP disclosed
US-20120035304-A1 METHOD FOR INHIBITING CRYSTAL GROWTH RATE OF AMIDE COMPOUND AND METHOD FOR PRODUCING MOLDED ARTICLE OF POLYOLEFIN-BASED RESIN NEW JAPAN CHEMICAL CO., LTD. (JP) 2012-02-09 US disclosed
US-20110212358-A1 LAMINATED POROUS FILM AND SEPARATOR FOR BATTERY MITSUBISHI PLASTICS, INC. (JP) 2011-09-01 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-20120035304-A1 METHOD FOR INHIBITING CRYSTAL GROWTH RATE OF AMIDE COMPOUND AND METHOD FOR PRODUCING MOLDED ARTICLE OF POLYOLEFIN-BASED RESIN MNAT1, RFT1, RTF1 CYP2C9 3051/4885SMN1; SMN2 3244/4885RAB9A 4496/4885

“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.