SCHEMBL10192577

SCHEMBL10192577

Cc1cc(N)ccc1NC1CCCNC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKCZ Q05513 9/20 0.49
PRKD2 Q9BZL6 7/20 0.49
BRD4 O60885 3/20 0.44
CHEK1 O14757 3/20 0.42
KCNH2 Q12809 3/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ATAD2 Q6PL18 2/20 0.41
FLT3 P36888 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
SCHEMBL5386930 0.91 BRD4 (0.48) PRKCZPRKD2BRD4KCNH2ALDH1A1
SCHEMBL27583230 0.79 PRKCZ (0.52) PRKCZPRKD2BRD4CHEK1KCNH2
SCHEMBL12676577 0.75 PRKCZ (0.49) PRKCZPRKD2CHEK1FLT3
SCHEMBL19675966 0.75 PRKCZ (0.52) PRKCZPRKD2CHEK1KCNH2
SCHEMBL31357223 0.75 PRKCZ (0.52) PRKCZPRKD2CHEK1KCNH2
SCHEMBL5395259 0.74 CHEK1 (0.41) PRKCZPRKD2BRD4CHEK1MAPT
SCHEMBL9310589 0.74 PRKCZ (0.53) PRKCZPRKD2BRD4ALDH1A1LMNA
SCHEMBL5403382 0.73 BRD4 (0.43) PRKCZPRKD2BRD4KCNH2ATAD2
SCHEMBL10192579 0.73 KAT2B (0.45) ALDH1A1LMNAMAPTCRHBPCRHR2
SCHEMBL8236935 0.73 KDM4E (0.65) PRKCZPRKD2CHEK1KCNH2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140364430-A1 METHODS FOR TREATING SCHIZOPHRENIA AFRAXIS HOLDINGS INC (US) 2014-12-11 US disclosed
US-8674095-B2 Compounds for treating neuropsychiatric conditions AFRAXIS HOLDINGS, INC. (US) 2014-03-18 US disclosed
US-20120184547-A1 METHODS FOR TREATING SCHIZOPHRENIA AFRAXIS, INC. (US) 2012-07-19 US disclosed
US-20120046283-A1 COMPOUNDS FOR TREATING NEUROPSYCHIATRIC CONDITIONS AFRAXIS INC. (US) 2012-02-23 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-20140364430-A1 METHODS FOR TREATING SCHIZOPHRENIA GRIN2A, GRIN2C, GRIN3A PRKCZ 157/4885PRKD2 368/4885BRD4 469/4885
US-20120046283-A1 COMPOUNDS FOR TREATING NEUROPSYCHIATRIC CONDITIONS PAK2, PAK5, PAK6 PRKCZ 733/4885PRKD2 220/4885BRD4 248/4885
US-20120184547-A1 METHODS FOR TREATING SCHIZOPHRENIA PAK2, PAK3, PAK4 PRKCZ 207/4885PRKD2 309/4885BRD4 519/4885

“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.