SCHEMBL2491500

SCHEMBL2491500

Cc1ccccc1-c1cccc(CN2CCCC2)c1-c1ccccc1C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.49
HTR7 P34969 2/20 0.48
CYP2A13 Q16696 1/20 0.47
LMNA P02545 2/20 0.46
ACHE P22303 1/20 0.46
ALDH1A1 P00352 3/20 0.46
ADORA2A P29274 3/20 0.44
ADORA1 P30542 3/20 0.44
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
CHRNA7 P36544 1/20 0.42
MEN1 O00255 1/20 0.40
HRH3 Q9Y5N1 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
SCHEMBL2491547 0.98 ALDH1A1 (0.49) KMT2AHTR7CYP2A13LMNAACHE
SCHEMBL6791318 0.87 HTR7 (0.59) KMT2AHTR7CYP2A13LMNAACHE
SCHEMBL2493857 0.87 LMNA (0.66) KMT2AHTR7CYP2A13LMNAACHE
SCHEMBL329437 0.79 KMT2A (0.72) KMT2ACYP2A13LMNAACHEALDH1A1
SCHEMBL2493514 0.78 MPO (0.54) LMNAACHEALDH1A1ADORA2AADORA1
SCHEMBL1164984 0.78 KMT2A (0.70) KMT2ACYP2A13LMNAACHEALDH1A1
SCHEMBL1882777 0.78 KMT2A (0.70) KMT2ACYP2A13LMNAACHEALDH1A1
SCHEMBL2493434 0.78 HTR7 (0.58) KMT2AHTR7ALDH1A1KDM4EMEN1
SCHEMBL2494461 0.77 MPO (0.53) KMT2ALMNAALDH1A1ADORA2AADORA1
SCHEMBL2492921 0.77 MEN1 (0.59) KMT2AHTR7ALDH1A1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2380567-B1 MELANIN PRODUCTION INHIBITOR POLA CHEM IND INC (JP) 2019-01-16 EP disclosed
EP-3009123-A1 MELANIN PRODUCTION INHIBITOR Pola Chemical Industries Inc. (JP) 2016-04-20 EP disclosed
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR POLA CHEMICAL INDUSTRIES INC. (JP) 2015-11-19 US disclosed
EP-2845587-A2 Melanin production inhibitor Pola Chemical Industries Inc. (JP) 2015-03-11 EP disclosed
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR POLA CHEMICAL INDUSTRIES INC. (JP) 2014-12-11 US disclosed
US-8846012-B2 Melanin production inhibitor POLA CHEMICAL INDUSTRIES INC. (JP) 2014-09-30 US disclosed
EP-2380567-A1 MELANIN PRODUCTION INHIBITOR Pola Chemical Industries Inc. (JP) 2011-10-26 EP disclosed
US-20110243865-A1 MELANIN PRODUCTION INHIBITOR POLA CHEMICAL INDUSTRIES INC. (JP) 2011-10-06 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 (3 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-20110243865-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, TH KMT2A 2108/4885HTR7 241/4885CYP2A13 17/4885
US-20150328107-A1 MELANIN PRODUCTION INHIBITOR TYR, MC1R, F12 KMT2A 2219/4885HTR7 164/4885CYP2A13 14/4885
US-20140363389-A1 MELANIN PRODUCTION INHIBITOR TYR, F12, MC1R KMT2A 2287/4885HTR7 178/4885CYP2A13 16/4885

“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.