SCHEMBL17059010

SCHEMBL17059010

Cc1ccc(C)c2sc(C#Cc3ccccc3)nc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 15/20 0.49
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
CYP2C19 P33261 1/20 0.40
THPO P40225 1/20 0.40
KMT2A Q03164 1/20 0.40
GRIN2B Q13224 1/20 0.40
GRM1 Q13255 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
SCHEMBL23485699 0.79 AHR (0.34) GRM5LMNACCR6AHR
SCHEMBL6310651 0.76 GRM5 (0.54) GRM5NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL18873200 0.74 AHR (0.47) SMN1; SMN2KDM4EMEN1ALDH1A1TP53
SCHEMBL1658046 0.70 SMN1; SMN2 (0.54) GRM5NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL19135632 0.70 GRM5 (0.44) GRM5NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL19135631 0.70 GRM5 (0.44) GRM5NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL18873092 0.69 ADORA3 (0.49) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1
SCHEMBL106320 0.67 ALDH1A1 (0.55) RAB9ASMN1; SMN2ALDH1A1TP53CYP3A4
SCHEMBL24850641 0.67 GRM5 (0.59) GRM5NPC1RAB9ASMN1; SMN2KDM4E
SCHEMBL22174649 0.67 RARA (0.49) NPC1RAB9ASMN1; SMN2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9500790-B2 Optical film, circularly polarizing plate, and image display device Konica Minolta, Inc. (JP) 2016-11-22 US disclosed
US-20150247963-A1 OPTICAL FILM, CIRCULARLY POLARIZING PLATE, AND IMAGE DISPLAY DEVICE Konica Minolta, Inc. (JP) 2015-09-03 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-20150247963-A1 OPTICAL FILM, CIRCULARLY POLARIZING PLATE, AND IMAGE DISPLAY DEVICE SUN2, HTR3D, CRY1 GRM5 3469/4885NPC1 1653/4885RAB9A 2452/4885

“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.