SCHEMBL21297650

SCHEMBL21297650

Cc1ccc2cc(-c3cnc(C)cn3)ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.53
CYP1A2 P05177 6/20 0.46
CYP2A6 P11509 4/20 0.46
TDP1 Q9NUW8 1/20 0.41
CCR1 P32246 2/20 0.38
CCR5 P51681 2/20 0.38
CCR8 P51685 2/20 0.38
CTRC Q99895 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
NPC1 O15118 2/20 0.37
CASP3 P42574 1/20 0.37
RAB9A P51151 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL16805039 0.86 ABL1 (0.53) ABL1CYP1A2CYP2A6CTRCNPC1
SCHEMBL18899556 0.86 ABL1 (0.60) ABL1CYP1A2CYP2A6NPC1CASP3
SCHEMBL29025766 0.83 ABL1 (0.54) ABL1CYP1A2CYP3A4CYP2C9
SCHEMBL30356537 0.83 ABL1 (0.54) ABL1CYP1A2CYP3A4CYP2C9
SCHEMBL20929593 0.81 CCR1 (0.56) CYP1A2CYP2A6TDP1CCR1CCR5
SCHEMBL10000240 0.81 KDM1A (0.47) ABL1CYP2A6TDP1CCR1CCR5
SCHEMBL17051555 0.79 KDM1A (0.46) ABL1CYP2A6TDP1CCR1CCR5
SCHEMBL17051511 0.79 KDM1A (0.46) ABL1TDP1CCR1CCR5CCR8
SCHEMBL15599290 0.78 ABL1 (0.43) ABL1CYP1A2CYP2A6TDP1CCR1
SCHEMBL23601607 0.78 KDM1A (0.53) NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10392343-B2 Polymerizable compound, polymerizable composition, polymer, and optically anisotropic product ZEON CORPORATION (JP) 2019-08-27 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-10392343-B2 Polymerizable compound, polymerizable composition, polymer, and optically anisotropic product ZYX, CCNY, PYM1 ABL1 2240/4885CYP1A2 992/4885CYP2A6 591/4885

“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.